data_2i4k_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 2i4k _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 ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.732 0.301 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.407 ' CB ' ' CD1' ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.46 HD21 HG13 ' A' ' 6' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.46 HG13 HD21 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.459 HD13 ' N ' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.504 ' CB ' HG12 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.447 ' CE1' ' HB ' ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.541 HG13 ' N ' ' A' ' 23' ' ' ALA . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.541 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' CE2' ' CD ' ' A' ' 98' ' ' ARG . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.497 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' HG22 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.401 HG21 ' N ' ' A' ' 29' ' ' GLN . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 5.2 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.406 ' CG2' ' CG ' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 ' CD1' ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 8.9 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HE3' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.435 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.463 HD21 ' CD2' ' A' ' 123' ' ' PHE . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.731 0.3 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.449 ' CD ' ' CE2' ' A' ' 24' ' ' TYR . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 49' ' ' PHE . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.459 ' N ' HD13 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.445 ' CE1' HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.515 HD23 HG13 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.509 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.509 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.433 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.405 ' HE3' ' CG2' ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.412 ' CB ' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.569 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.569 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.405 ' HB3' ' NE ' ' A' ' 36' ' ' ARG . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.438 ' CG ' ' O ' ' A' ' 2' ' ' PHE . 18.3 t80 . . . . . 0 CA--C 1.531 0.224 0 CA-C-O 120.68 0.276 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.459 HD21 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.459 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 ' CG2' ' N ' ' A' ' 15' ' ' GLY . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.421 ' N ' ' CG2' ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 23' ' ' ALA . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.51 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.423 ' CE ' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.459 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.418 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' NH2' ' HB2' ' A' ' 125' ' ' GLU . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.492 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.45 ' CZ ' ' CD1' ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.786 0.327 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.469 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.567 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.595 ' HB ' HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.502 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 3.3 t-20 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.598 ' HG3' HD11 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.598 HD11 ' HG3' ' A' ' 114' ' ' MET . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.543 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.439 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.796 0.332 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.57 ' HG ' ' HB ' ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.46 ' HB ' ' OG1' ' A' ' 28' ' ' THR . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.437 ' CD1' ' HA ' ' A' ' 102' ' ' GLU . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.493 ' N ' ' O ' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.455 ' N ' ' CG2' ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.538 HG23 ' N ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.538 ' N ' HG23 ' A' ' 22' ' ' VAL . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 10' ' ' ASP . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.46 ' OG1' ' HB ' ' A' ' 6' ' ' VAL . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.425 ' HB ' HD23 ' A' ' 4' ' ' LEU . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.43 ' CD1' HD11 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.552 ' CD1' ' CD2' ' A' ' 123' ' ' PHE . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.957 0.408 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.456 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.437 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.419 ' HG ' ' CG1' ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.435 ' O ' HG21 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.454 ' HD2' ' HE1' ' A' ' 114' ' ' MET . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.53 ' O ' HD11 ' A' ' 115' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.57 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.454 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.414 ' HA ' HD22 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.457 ' HA ' ' CD2' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.552 ' CD2' ' CD1' ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 p90 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.836 0.351 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' HB ' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.455 HG22 ' N ' ' A' ' 7' ' ' GLY . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.455 ' N ' HG22 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.426 HD11 ' N ' ' A' ' 102' ' ' GLU . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HA ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.436 HG22 ' CZ ' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.436 ' CZ ' HG22 ' A' ' 14' ' ' ILE . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.502 HG12 ' N ' ' A' ' 23' ' ' ALA . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.502 ' N ' HG12 ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' CE2' ' CD1' ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.437 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.405 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.414 ' O ' ' CB ' ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.415 ' HD3' ' CZ ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 38' ' ' LYS . 1.1 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.415 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.427 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.586 HG21 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HD2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.419 ' CE1' ' OH ' ' A' ' 24' ' ' TYR . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.419 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.482 ' CD2' ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.862 0.363 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.401 ' CG ' ' HG2' ' A' ' 11' ' ' PRO . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.449 ' CD1' ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 6' ' ' VAL . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.486 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.539 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.546 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.2 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.546 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 0.8 OUTLIER -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.61 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 117' ' ' ASP . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.46 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.61 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.61 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.407 ' CD1' ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.488 ' CZ ' ' CD1' ' A' ' 34' ' ' LEU . 1.8 t80 . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 119.969 -0.063 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.48 ' HB2' ' CE2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.402 HG11 ' CG1' ' A' ' 26' ' ' VAL . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.435 ' CD1' ' HB2' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.499 ' O ' HG12 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.482 HG11 ' N ' ' A' ' 23' ' ' ALA . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.482 ' N ' HG11 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.457 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.402 ' CG1' HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.521 HG22 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.458 ' HB3' ' HD2' ' A' ' 33' ' ' PRO . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.488 ' CD1' ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.549 ' CB ' ' O ' ' A' ' 35' ' ' PHE . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.466 ' CD1' ' CD1' ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.44 HD22 ' CD2' ' A' ' 123' ' ' PHE . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.825 0.345 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.466 ' CD1' ' CD1' ' A' ' 49' ' ' PHE . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.522 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.482 ' O ' HG12 ' A' ' 108' ' ' ILE . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.621 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.621 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 10.3 t-80 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HD2' ' CD2' ' A' ' 111' ' ' HIS . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.479 ' HE2' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.497 ' CD1' ' O ' ' A' ' 111' ' ' HIS . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.478 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.809 0.338 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.419 ' CD1' ' HB ' ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.732 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.451 HG22 ' CA ' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HB2' HG13 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.432 ' CD1' ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.62 HG11 ' N ' ' A' ' 23' ' ' ALA . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.62 ' N ' HG11 ' A' ' 22' ' ' VAL . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.732 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.44 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.404 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.404 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.743 0.306 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.451 ' CA ' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.435 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.449 ' N ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.465 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.446 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.465 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.509 ' HA ' HD11 ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.446 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.459 ' O ' ' HG2' ' A' ' 114' ' ' MET . 0.4 OUTLIER -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.459 ' HG2' ' O ' ' A' ' 111' ' ' HIS . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.576 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.576 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.415 ' HB3' ' NH2' ' A' ' 36' ' ' ARG . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.861 0.362 . . . . 0.0 111.265 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.423 HD22 HG12 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.693 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.521 HG23 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 10' ' ' ASP . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' VAL . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 23' ' ' ALA . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.59 HG12 ' N ' ' A' ' 23' ' ' ALA . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.59 ' N ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.476 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.693 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.563 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.585 HG23 ' HG3' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.423 ' CD2' ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HG3' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.563 ' HB3' ' HA ' ' A' ' 29' ' ' GLN . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.406 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.44 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.476 ' CE2' HG22 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.458 HD23 ' CD2' ' A' ' 123' ' ' PHE . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t . . . . . 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.75 0.309 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.521 ' HG2' HG23 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.514 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.452 ' CG ' ' N ' ' A' ' 105' ' ' LEU . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.452 ' N ' ' CG ' ' A' ' 104' ' ' TYR . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.45 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.45 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.462 ' HE1' ' CG2' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.505 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.505 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.8 p90 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.821 0.343 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.447 HD21 ' CG2' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.418 ' CG1' ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.448 HD12 ' HA ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.449 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 10' ' ' ASP . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.494 ' HB ' ' CD1' ' A' ' 21' ' ' TYR . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HB ' ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 23' ' ' ALA . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.6 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.421 HG11 ' CE2' ' A' ' 49' ' ' PHE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.585 ' OG1' ' HB3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.625 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.612 ' HD3' ' N ' ' A' ' 32' ' ' LEU . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.591 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.402 HG12 HG21 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.557 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.464 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.46 ' CG ' HD11 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.467 ' CD1' ' CD2' ' A' ' 123' ' ' PHE . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.411 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.845 0.355 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.411 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.437 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.449 ' HD3' ' HA ' ' A' ' 9' ' ' THR . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.472 ' O ' ' CD1' ' A' ' 104' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HA ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.418 ' CD2' ' CG1' ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.477 ' O ' HG21 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.474 ' CG2' ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.477 HG21 ' O ' ' A' ' 106' ' ' GLN . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.41 ' O ' HD22 ' A' ' 115' ' ' LEU . 50.0 m170 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.461 ' CB ' HG13 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.474 ' CG2' ' CG2' ' A' ' 108' ' ' ILE . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.467 ' CD2' ' CD1' ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.401 ' CD2' ' CG1' ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 4' ' ' LEU . 2.9 t80 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.656 0.265 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.485 HD21 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.405 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.448 HG13 HD23 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.448 ' N ' ' CG2' ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.41 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.614 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.474 HG22 ' N ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.474 ' N ' HG22 ' A' ' 22' ' ' VAL . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.419 ' CE2' HD11 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HE3' ' HD3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.414 ' CG2' HD12 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.468 HG21 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.415 HD21 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HB2' HG21 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.491 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.632 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.477 ' CE2' HD12 ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.436 HD21 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.847 0.356 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.477 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.504 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.514 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.646 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.499 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.584 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.469 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.584 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 125' ' ' GLU . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' A' ' 124' ' ' LEU . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 22.7 t80 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 110.742 -0.095 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 109' ' ' VAL . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.519 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.504 HD13 ' N ' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.527 HG23 ' N ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' N ' HG23 ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.496 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.534 ' CG2' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.539 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.534 HG11 ' CG2' ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.462 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.485 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.462 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.423 HD12 ' NH1' ' A' ' 107' ' ' ARG . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.843 0.354 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.417 ' CB ' HG23 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.504 ' N ' HD13 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.58 HD21 ' O ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.609 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.477 ' O ' ' HE3' ' A' ' 114' ' ' MET . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.573 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.609 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.431 ' O ' HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.477 ' HE3' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.573 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.424 ' CZ ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' CZ ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . 0.573 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.746 0.308 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -157.65 24.81 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' CB ' ' CD1' ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.46 HD21 HG13 ' A' ' 6' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.46 HG13 HD21 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.459 HD13 ' N ' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.504 ' CB ' HG12 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.447 ' CE1' ' HB ' ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.541 HG13 ' N ' ' A' ' 23' ' ' ALA . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.541 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' CE2' ' CD ' ' A' ' 98' ' ' ARG . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.497 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' HG22 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.401 HG21 ' N ' ' A' ' 29' ' ' GLN . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 5.2 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.406 ' CG2' ' CG ' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 ' CD1' ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 8.9 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HE3' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.435 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.463 HD21 ' CD2' ' A' ' 123' ' ' PHE . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 68' ' ' PRO . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -31.96 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.93 -25.43 11.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.554 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -24.02 11.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.601 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.05 -176.11 1.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.869 0.366 . . . . 0.0 111.107 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.0 p -116.82 -33.49 4.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.326 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.53 -66.54 0.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -84.78 153.13 23.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.037 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.39 55.51 2.19 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.666 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 55.47 87.5 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 0.0 110.942 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.461 ' O ' HG13 ' A' ' 66' ' ' ILE . 5.8 tp -98.4 35.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.6 p -132.31 98.46 16.92 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.335 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 41.1 Cg_exo -55.94 -43.57 55.63 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.454 2.103 . . . . 0.0 112.128 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 72.7 Cg_exo -51.01 -167.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.816 2.344 . . . . 0.0 112.231 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.509 ' CD ' ' CB ' ' A' ' 69' ' ' PRO . 80.3 Cg_exo -46.01 173.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.451 2.101 . . . . 0.0 112.712 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.41 ' HG3' ' CD ' ' A' ' 107' ' ' ARG . 82.2 Cg_exo -43.1 -38.92 7.83 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.754 2.302 . . . . 0.0 112.552 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -138.63 179.9 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.83 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -64.35 103.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.908 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.75 41.61 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.938 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mt 68.88 -65.43 0.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.024 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -41.29 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.256 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.36 -94.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.601 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -115.81 129.58 56.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 110.98 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 70.2 m -163.99 -60.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.863 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.48 38.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.849 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 m -57.72 -45.96 86.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.245 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.3 mtpp 67.38 -69.41 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.4 m -61.6 -179.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.302 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.06 -78.66 0.51 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.463 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -170.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.951 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -72.07 150.06 44.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -140.87 -47.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.853 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.5 p 62.55 122.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.016 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.9 m -103.18 -31.31 10.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p -150.49 172.14 15.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.449 ' CD ' ' CE2' ' A' ' 24' ' ' TYR . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 49' ' ' PHE . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.459 ' N ' HD13 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.417 ' HB2' ' HG3' ' A' ' 70' ' ' PRO . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.445 ' CE1' HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.515 HD23 HG13 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.509 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.41 ' CD ' ' HG3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.509 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.433 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.405 ' HE3' ' CG2' ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 108' ' ' ILE . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.412 ' CB ' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.569 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.569 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.405 ' HB3' ' NE ' ' A' ' 36' ' ' ARG . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.438 ' CG ' ' O ' ' A' ' 2' ' ' PHE . 18.3 t80 -92.2 8.06 39.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.192 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.459 HD21 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.459 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 ' CG2' ' N ' ' A' ' 15' ' ' GLY . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.421 ' N ' ' CG2' ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 23' ' ' ALA . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.51 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.423 ' CE ' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.459 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.418 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' NH2' ' HB2' ' A' ' 125' ' ' GLU . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.492 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' CZ ' ' CD1' ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t -58.17 -38.15 76.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.96 -44.2 66.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.79 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mmpm? -61.86 -25.73 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.084 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 65.04 -76.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.6 m -137.41 172.66 12.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.907 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -174.31 136.83 0.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -100.42 153.13 19.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.847 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.93 12.17 4.55 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.867 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 2.6 m-85 -108.53 63.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.797 0.332 . . . . 0.0 110.557 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.414 HD11 ' CE1' ' A' ' 111' ' ' HIS . 3.6 mp 69.99 -65.61 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.852 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.76 146.26 31.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.58 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 52.3 Cg_exo -52.07 -45.31 39.78 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.552 2.168 . . . . 0.0 112.783 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 73.7 Cg_exo -50.39 145.23 21.97 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.398 2.066 . . . . 0.0 112.338 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.18 172.39 0.3 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 112.442 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.28 -48.37 22.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.712 2.275 . . . . 0.0 112.274 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -178.02 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.981 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.9 15.7 1.91 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.325 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 75' ' ' LEU . 5.3 p 67.56 -64.94 0.25 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.297 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.445 ' N ' ' OG ' ' A' ' 74' ' ' SER . 0.9 OUTLIER 59.84 39.61 20.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 0.0 110.824 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 tp -151.12 55.14 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.035 0.445 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.88 36.79 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.649 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 18.9 mmt -133.1 94.88 3.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 110.867 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.81 -165.91 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -57.51 163.15 2.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.964 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.21 -46.39 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.406 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.515 ' O ' ' CG2' ' A' ' 83' ' ' VAL . 0.1 OUTLIER -171.07 -144.45 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.898 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.515 ' CG2' ' O ' ' A' ' 82' ' ' LYS . 11.0 m 53.75 164.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.069 0.462 . . . . 0.0 111.781 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.73 95.75 0.33 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.344 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -54.28 105.56 0.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.848 0.356 . . . . 0.0 111.08 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -138.64 121.95 17.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.865 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.7 t0 63.79 136.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 11.2 m -161.74 72.0 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.774 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.3 t 59.49 66.28 1.04 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.763 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m -124.0 135.0 53.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.957 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.469 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.567 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.595 ' HB ' HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.502 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 3.3 t-20 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.414 ' CE1' HD11 ' A' ' 66' ' ' ILE . 15.5 m170 -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.598 ' HG3' HD11 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.598 HD11 ' HG3' ' A' ' 114' ' ' MET . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.543 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.878 0.371 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.439 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -111.09 -171.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.73 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.57 ' HG ' ' HB ' ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.46 ' HB ' ' OG1' ' A' ' 28' ' ' THR . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.437 ' CD1' ' HA ' ' A' ' 102' ' ' GLU . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.493 ' N ' ' O ' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.455 ' N ' ' CG2' ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.538 HG23 ' N ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.538 ' N ' HG23 ' A' ' 22' ' ' VAL . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.456 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 10' ' ' ASP . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.46 ' OG1' ' HB ' ' A' ' 6' ' ' VAL . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.425 ' HB ' HD23 ' A' ' 4' ' ' LEU . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.43 ' CD1' HD11 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.552 ' CD1' ' CD2' ' A' ' 123' ' ' PHE . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' O ' ' CB ' ' A' ' 58' ' ' GLU . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -76.18 -44.13 39.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 54' ' ' GLU . 42.3 tt0 -61.34 -25.75 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.448 ' O ' ' N ' ' A' ' 61' ' ' SER . 2.6 mtpm? -83.51 -37.96 22.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.477 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 44.39 -90.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.297 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 59' ' ' LYS . 14.2 p 58.13 163.3 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 0.0 111.186 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.7 -73.24 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.2 150.23 37.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.035 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -154.72 -44.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.62 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.418 ' CD2' ' CG ' ' A' ' 114' ' ' MET . 4.1 m-85 -103.07 152.06 21.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.801 0.334 . . . . 0.0 110.856 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 pt -65.13 -30.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.096 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.453 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 14.7 p -62.92 112.74 7.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.486 ' HB2' ' HD3' ' A' ' 69' ' ' PRO . 27.5 Cg_exo -59.17 -49.96 9.77 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.049 1.833 . . . . 0.0 112.271 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 68' ' ' PRO . 39.2 Cg_exo -60.14 143.38 99.54 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.152 1.901 . . . . 0.0 111.665 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -51.59 178.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.278 1.985 . . . . 0.0 112.194 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.483 ' HB3' ' HD3' ' A' ' 107' ' ' ARG . 80.7 Cg_exo -46.15 -65.41 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.657 2.238 . . . . 0.0 112.17 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -179.55 106.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.74 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.74 138.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.971 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -113.39 108.52 17.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.66 167.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.062 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.72 -44.33 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.923 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.6 -105.53 3.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.654 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -85.91 156.54 20.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.767 0.318 . . . . 0.0 110.935 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.0 p -79.93 -43.73 21.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp 60.82 157.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.901 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.4 m 41.79 72.42 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.678 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -167.75 154.89 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.3 t -111.45 -41.35 4.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 113.49 63.28 0.43 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -103.15 67.23 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.875 0.369 . . . . 0.0 110.858 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.22 -179.95 5.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -54.37 173.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.013 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.8 -28.56 11.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 39.6 p -57.43 -30.72 65.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.05 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p -170.93 67.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.832 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.456 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.437 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.419 ' HG ' ' CG1' ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.435 ' O ' HG21 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.483 ' HD3' ' HB3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.53 ' O ' HD11 ' A' ' 115' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.57 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.454 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.53 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.414 ' HA ' HD22 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.457 ' HA ' ' CD2' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.552 ' CD2' ' CD1' ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.789 0.328 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 p90 -145.07 141.66 29.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.051 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' HB ' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.455 HG22 ' N ' ' A' ' 7' ' ' GLY . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.455 ' N ' HG22 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.426 HD11 ' N ' ' A' ' 102' ' ' GLU . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HA ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.436 HG22 ' CZ ' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.436 ' CZ ' HG22 ' A' ' 14' ' ' ILE . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.502 HG12 ' N ' ' A' ' 23' ' ' ALA . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.502 ' N ' HG12 ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' CE2' ' CD1' ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.437 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.405 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.414 ' O ' ' CB ' ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.415 ' HD3' ' CZ ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 38' ' ' LYS . 1.1 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.415 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.427 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.586 HG21 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HD2' HG21 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.419 ' CE1' ' OH ' ' A' ' 24' ' ' TYR . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.419 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 101' ' ' LEU . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.482 ' CD2' ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m -69.33 -34.08 74.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -74.98 -42.76 56.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.811 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.7 tpmp? -75.11 -43.24 53.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER 66.52 -72.16 0.09 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m -67.25 -51.37 53.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.84 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.86 96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.787 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -59.38 116.95 4.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.83 -55.87 0.64 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.596 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.553 ' CE2' ' HG2' ' A' ' 114' ' ' MET . 4.0 t80 -110.05 126.24 53.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.873 0.368 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.446 ' CD1' ' N ' ' A' ' 66' ' ' ILE . 0.2 OUTLIER -143.26 41.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.841 179.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.531 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -76.53 123.65 87.75 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.125 -179.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.559 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 17.4 Cg_endo -63.34 -30.08 72.88 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.568 2.179 . . . . 0.0 114.625 -179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.574 ' HB2' ' HD2' ' A' ' 71' ' ' PRO . 74.8 Cg_exo -48.87 -169.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.346 2.031 . . . . 0.0 112.819 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.512 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 86.6 Cg_exo -42.28 -45.99 7.6 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.72 2.28 . . . . 0.0 114.048 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.574 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 74.5 Cg_exo -49.18 89.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.161 1.908 . . . . 0.0 112.512 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 70' ' ' PRO . 3.1 pt-20 -167.86 -177.12 3.3 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.719 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.54 -31.87 13.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.7 t -65.13 78.97 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 tt -176.29 -52.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.7 tt -155.34 97.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.66 -66.36 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.409 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.7 mtm 61.27 28.51 18.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 0.0 111.198 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.63 -152.82 0.39 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.713 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.8 85.78 0.11 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.909 0.385 . . . . 0.0 110.931 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.1 m -103.99 143.64 15.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.047 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt 59.58 63.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.711 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.6 123.63 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.182 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -125.33 11.35 7.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.839 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -62.99 104.59 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.793 0.33 . . . . 0.0 110.881 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 153.9 19.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.947 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -172.03 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.9 t -171.4 -70.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.902 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.4 t -163.34 -171.5 2.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -166.52 91.73 0.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.931 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.401 ' CG ' ' HG2' ' A' ' 11' ' ' PRO . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.449 ' CD1' ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 6' ' ' VAL . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.486 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.539 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.546 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.2 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.546 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 0.8 OUTLIER -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.61 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 117' ' ' ASP . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.46 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.61 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.61 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.407 ' CD1' ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.816 0.341 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.488 ' CZ ' ' CD1' ' A' ' 34' ' ' LEU . 1.8 t80 57.71 -111.8 0.61 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.48 ' HB2' ' CE2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.402 HG11 ' CG1' ' A' ' 26' ' ' VAL . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.435 ' CD1' ' HB2' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' O ' HG12 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.482 HG11 ' N ' ' A' ' 23' ' ' ALA . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.482 ' N ' HG11 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.457 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.402 ' CG1' HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.521 HG22 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.458 ' HB3' ' HD2' ' A' ' 33' ' ' PRO . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.488 ' CD1' ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.549 ' CB ' ' O ' ' A' ' 35' ' ' PHE . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.466 ' CD1' ' CD1' ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.44 HD22 ' CD2' ' A' ' 123' ' ' PHE . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t -76.13 -31.58 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -52.61 -25.35 10.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.64 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -53.64 -23.96 12.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.676 0.274 . . . . 0.0 111.227 -179.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.421 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 6.5 m80 54.05 96.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.157 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.3 m -164.54 164.17 21.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.954 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -85.37 -54.16 4.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 19.7 p30 -61.33 153.29 27.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.816 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -53.4 -28.72 36.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 177.69 -166.5 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.831 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 pp -110.16 32.65 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.945 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -125.03 159.0 61.14 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.039 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.549 ' HB2' ' HD2' ' A' ' 70' ' ' PRO . 11.2 Cg_endo -55.35 -175.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.584 2.19 . . . . 0.0 112.364 -179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.408 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 39.2 Cg_exo -61.15 -46.49 15.31 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.866 2.378 . . . . 0.0 114.405 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.593 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 36.6 Cg_exo -57.67 -53.29 4.72 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.143 1.896 . . . . 0.0 113.164 -178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 70' ' ' PRO . 51.8 Cg_exo -54.76 -22.33 28.93 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.01 1.807 . . . . 0.0 112.221 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -86.81 -73.83 0.45 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.994 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 tptp 54.19 -102.1 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.787 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 46.35 -169.07 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.831 0.348 . . . . 0.0 111.219 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.421 ' O ' ' CG2' ' A' ' 76' ' ' ILE . 0.0 OUTLIER -166.08 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.421 ' CG2' ' O ' ' A' ' 75' ' ' LEU . 1.9 tt 50.95 169.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.46 20.58 36.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.778 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.6 mmm 61.73 116.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 49.55 77.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.44 133.86 53.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.175 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.7 p -175.32 -52.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.874 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 84' ' ' GLY . 6.0 tptt 51.67 173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.951 0.405 . . . . 0.0 111.717 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 58.0 t 53.85 -83.73 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.619 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 82' ' ' LYS . . . 120.26 -26.24 7.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -110.56 -167.79 1.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.824 0.345 . . . . 0.0 110.85 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -85.28 133.14 34.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -173.5 105.06 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p 67.01 11.95 8.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.569 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.3 m 46.13 30.19 0.92 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.838 0.351 . . . . 0.0 111.228 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 62.94 37.35 12.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.466 ' CD1' ' CD1' ' A' ' 49' ' ' PHE . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.522 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.482 ' O ' HG12 ' A' ' 108' ' ' ILE . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.621 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.621 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 10.3 t-80 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HD2' ' CD2' ' A' ' 111' ' ' HIS . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.479 ' HE2' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.497 ' CD1' ' O ' ' A' ' 111' ' ' HIS . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.478 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.832 0.348 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -127.81 -166.43 1.61 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.926 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' CD1' ' HB ' ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.732 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.451 HG22 ' CA ' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HB2' HG13 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.432 ' CD1' ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.62 HG11 ' N ' ' A' ' 23' ' ' ALA . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.62 ' N ' HG11 ' A' ' 22' ' ' VAL . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.732 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.44 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.404 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.404 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -76.14 -32.94 59.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.88 -37.52 86.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.217 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' O ' ' N ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -59.11 -46.43 88.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.009 -179.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 m80 42.85 -92.68 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.428 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 59' ' ' LYS . 3.2 m 45.91 78.05 0.07 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 111.479 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.0 -158.88 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.82 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -41.89 153.44 0.06 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.427 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -37.77 -91.93 0.01 OUTLIER Glycine 0 C--N 1.333 0.367 0 CA-C-N 116.09 -0.504 . . . . 0.0 113.272 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -114.19 -79.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.581 0.229 . . . . 0.0 110.966 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.2 mp -148.87 -59.71 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.756 0.312 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.414 ' O ' ' HG2' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -113.79 126.6 27.86 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.494 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 36.3 Cg_exo -58.52 -41.22 67.07 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.843 2.362 . . . . 0.0 113.97 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 52.3 Cg_exo -53.08 -56.81 2.44 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.414 2.076 . . . . 0.0 114.23 -178.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.48 ' CD ' ' HB2' ' A' ' 69' ' ' PRO . 6.1 Cg_exo -45.95 -57.55 2.13 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 121.873 1.716 . . . . 0.0 112.678 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.476 ' HD3' ' CB ' ' A' ' 70' ' ' PRO . 50.8 Cg_exo -50.76 -164.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.365 2.043 . . . . 0.0 112.478 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.45 ' HG2' ' HD2' ' A' ' 107' ' ' ARG . 1.5 pp20? -102.65 -156.59 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.546 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.04 177.41 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.001 0.429 . . . . 0.0 111.457 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -55.41 5.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.707 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.9 tp 179.51 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.622 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 16.4 pt 44.14 87.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 111.66 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 172.35 141.85 3.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.3 mtp 62.73 31.35 16.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.931 0.396 . . . . 0.0 110.881 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.62 -78.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -110.74 -24.35 10.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.171 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.61 178.12 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.298 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.98 22.28 7.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.176 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.6 t 68.01 -68.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.182 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 101.25 -153.5 19.0 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.496 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.71 30.23 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -153.03 125.27 8.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.799 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.67 -167.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.2 t 66.66 108.24 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.952 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.4 m 60.91 88.42 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t -152.97 23.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.115 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.451 ' CA ' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.435 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.449 ' N ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.465 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.446 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.465 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.509 ' HA ' HD11 ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.446 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.459 ' O ' ' HG2' ' A' ' 114' ' ' MET . 0.4 OUTLIER -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.459 ' HG2' ' O ' ' A' ' 111' ' ' HIS . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.576 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.576 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.415 ' HB3' ' NH2' ' A' ' 36' ' ' ARG . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.771 0.319 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -156.98 -42.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.265 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.423 HD22 HG12 ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.693 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.521 HG23 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 10' ' ' ASP . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' VAL . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 23' ' ' ALA . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.59 HG12 ' N ' ' A' ' 23' ' ' ALA . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.59 ' N ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.476 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.693 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.563 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.585 HG23 ' HG3' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.423 ' CD2' ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HG3' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.563 ' HB3' ' HA ' ' A' ' 29' ' ' GLN . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.497 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.406 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.44 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.476 ' CE2' HG22 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.458 HD23 ' CD2' ' A' ' 123' ' ' PHE . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t -76.22 -44.36 37.95 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.05 -48.2 25.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.8 OUTLIER -57.04 -46.21 82.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.194 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 1.0 OUTLIER 178.54 102.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.167 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.94 137.57 36.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 62.7 -131.64 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.486 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -50.58 117.11 2.24 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.853 0.358 . . . . 0.0 111.205 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.64 42.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.517 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -165.68 88.38 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.676 0.274 . . . . 0.0 111.092 -179.877 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 42.07 -89.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.854 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.44 ' N ' ' O ' ' A' ' 65' ' ' PHE . 10.9 p -62.5 109.7 2.62 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 120.397 0.142 . . . . 0.0 111.123 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.428 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 4.6 Cg_exo -42.6 -54.22 3.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.867 2.378 . . . . 0.0 112.975 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 68' ' ' PRO . 63.2 Cg_exo -36.9 112.81 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.056 2.504 . . . . 0.0 113.177 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' CB ' ' CD ' ' A' ' 71' ' ' PRO . 63.2 Cg_exo -51.82 -175.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.699 2.266 . . . . 0.0 112.402 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.421 ' O ' ' N ' ' A' ' 73' ' ' LYS . 14.9 Cg_exo -68.93 58.18 1.15 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.866 2.377 . . . . 0.0 112.646 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 50.45 -88.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.492 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -123.83 -172.93 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.11 -79.19 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.67 100.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt -149.22 46.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.977 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.0 101.9 0.85 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.48 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 1.6 ptp -115.27 -38.42 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.843 0.354 . . . . 0.0 110.923 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -151.72 -79.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.01 171.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.6 p -178.42 65.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.053 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -116.95 134.77 54.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.093 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.1 p -168.24 156.22 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.022 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 127.81 -48.77 0.95 Allowed Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.2 73.33 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.819 0.342 . . . . 0.0 110.887 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -140.02 125.9 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -80.68 60.83 4.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -83.97 -19.75 34.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.54 99.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.86 0.362 . . . . 0.0 111.045 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m 61.07 35.51 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.109 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.521 ' HG2' HG23 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.514 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.452 ' CG ' ' N ' ' A' ' 105' ' ' LEU . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.452 ' N ' ' CG ' ' A' ' 104' ' ' TYR . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.45 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.45 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.462 ' HE1' ' CG2' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.505 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.505 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.833 0.349 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -68.86 180.0 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.447 HD21 ' CG2' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.418 ' CG1' ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.448 HD12 ' HA ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.449 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 10' ' ' ASP . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.494 ' HB ' ' CD1' ' A' ' 21' ' ' TYR . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HB ' ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG13 ' N ' ' A' ' 23' ' ' ALA . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.6 ' N ' HG13 ' A' ' 22' ' ' VAL . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.421 HG11 ' CE2' ' A' ' 49' ' ' PHE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.585 ' OG1' ' HB3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.625 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.612 ' HD3' ' N ' ' A' ' 32' ' ' LEU . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.591 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.402 HG12 HG21 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.557 ' CG ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.464 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.46 ' CG ' HD11 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.467 ' CD1' ' CD2' ' A' ' 123' ' ' PHE . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.446 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -76.2 -44.01 39.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.38 -33.9 75.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.42 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -60.46 -27.76 67.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.152 -179.672 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.406 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 74.1 m80 -157.86 130.68 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.386 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -81.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.549 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.42 -40.07 3.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.773 0.32 . . . . 0.0 111.316 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -52.04 122.04 7.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.136 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.82 85.53 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.425 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.446 ' CZ ' ' CD1' ' A' ' 56' ' ' LEU . 1.4 m-85 61.57 -82.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.655 0.264 . . . . 0.0 110.989 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.1 mt -152.26 -49.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 111.057 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.512 ' O ' ' HD2' ' A' ' 70' ' ' PRO . 15.2 m -96.93 170.58 7.13 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.01 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.483 ' CD ' ' HB ' ' A' ' 67' ' ' VAL . 27.1 Cg_exo -64.36 -46.07 8.28 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.968 2.445 . . . . 0.0 114.37 -178.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.564 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 91.1 Cg_exo -42.62 -49.07 6.74 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.793 2.329 . . . . 0.0 113.627 -178.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.564 ' HD3' ' HB2' ' A' ' 69' ' ' PRO . 96.8 Cg_exo -40.35 -177.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.147 2.565 . . . . 0.0 113.557 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 70' ' ' PRO . 87.6 Cg_exo -47.68 150.91 3.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.632 2.221 . . . . 0.0 112.736 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -155.65 166.62 32.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.873 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mttp 64.0 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.15 94.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.056 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -116.97 43.31 2.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.3 mt -107.33 -19.37 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.314 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.3 -101.49 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.921 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.426 ' O ' ' N ' ' A' ' 80' ' ' LYS . 4.8 mtm 58.18 -88.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.422 0.154 . . . . 0.0 110.743 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 p 44.98 -90.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.506 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 78' ' ' MET . 0.4 OUTLIER 59.01 179.77 0.08 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.949 0.404 . . . . 0.0 111.202 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.8 m -81.97 -167.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.097 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp 63.7 115.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.871 0.367 . . . . 0.0 111.058 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.9 t -135.42 74.66 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 93.25 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.605 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -176.81 126.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.851 0.358 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.45 -179.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.064 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 t0 75.36 -167.19 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 45.8 t -53.54 -68.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.079 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.16 -73.23 0.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.804 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.411 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t -178.84 133.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.411 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.437 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.449 ' HD3' ' HA ' ' A' ' 9' ' ' THR . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.472 ' O ' ' CD1' ' A' ' 104' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HA ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 101' ' ' LEU . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.418 ' CD2' ' CG1' ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.477 ' O ' HG21 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.474 ' CG2' ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.477 HG21 ' O ' ' A' ' 106' ' ' GLN . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.41 ' O ' HD22 ' A' ' 115' ' ' LEU . 50.0 m170 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.424 ' O ' ' CE2' ' A' ' 65' ' ' PHE . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.461 ' CB ' HG13 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.474 ' CG2' ' CG2' ' A' ' 108' ' ' ILE . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.467 ' CD2' ' CD1' ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.401 ' CD2' ' CG1' ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.851 0.357 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.445 ' CE2' HD11 ' A' ' 4' ' ' LEU . 2.9 t80 -93.55 -21.55 19.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.126 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.485 HD21 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.405 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.448 HG13 HD23 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.448 ' N ' ' CG2' ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.41 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.614 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.474 HG22 ' N ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.474 ' N ' HG22 ' A' ' 22' ' ' VAL . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.419 ' CE2' HD11 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HE3' ' HD3' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.414 ' CG2' HD12 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.468 HG21 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.415 HD21 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.468 ' HB2' HG21 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.491 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.632 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.477 ' CE2' HD12 ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.436 HD21 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.31 -44.29 96.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.36 -47.92 25.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -39.99 95.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.087 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.3 t60 63.26 170.7 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.738 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.98 114.0 26.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -173.3 -49.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -116.19 147.01 41.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.771 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.59 -51.77 1.08 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.544 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -80.85 -44.43 18.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.689 0.28 . . . . 0.0 111.027 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 mm 71.23 -61.41 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.439 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.487 ' C ' ' CD ' ' A' ' 69' ' ' PRO . 31.0 m -59.66 137.7 89.81 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.98 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.578 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 53.8 Cg_endo -96.38 18.3 0.61 Allowed 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.98 2.454 . . . . 0.0 116.039 -178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.61 ' HB2' ' HD2' ' A' ' 71' ' ' PRO . 45.8 Cg_exo -54.01 -168.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.416 1.411 . . . . 0.0 111.874 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 69' ' ' PRO . 91.2 Cg_exo -42.57 -43.0 8.47 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.55 2.167 . . . . 0.0 113.84 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.61 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 41.9 Cg_exo -57.6 91.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.228 1.952 . . . . 0.0 112.115 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.422 ' O ' ' CG ' ' A' ' 73' ' ' LYS . 17.4 pt-20 -167.19 -38.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.263 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER 50.09 -177.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.51 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.44 43.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.819 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 tp 62.97 132.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.028 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mp -90.11 95.41 5.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.07 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.92 -171.46 9.56 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.327 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.68 19.5 1.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.153 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.78 -166.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mttm -143.05 138.81 30.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.885 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.0 m -79.59 110.65 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.168 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.26 107.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -47.84 -80.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.42 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.05 -58.73 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.805 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -80.64 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.572 0.225 . . . . 0.0 111.174 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.27 130.04 38.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -137.82 -50.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.3 t 62.18 -80.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.997 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.5 p -179.98 156.09 0.63 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -97.94 -31.25 12.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.477 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.504 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.514 ' O ' HG12 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.646 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.41 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.499 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.584 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.469 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.584 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' A' ' 125' ' ' GLU . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' A' ' 124' ' ' LEU . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 22.7 t80 58.11 -110.3 0.51 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.742 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 109' ' ' VAL . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.519 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.504 HD13 ' N ' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.527 HG23 ' N ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' N ' HG23 ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.496 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.534 ' CG2' HG11 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.539 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.534 HG11 ' CG2' ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.462 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.485 ' N ' ' CD2' ' A' ' 52' ' ' LEU . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.462 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.423 HD12 ' NH1' ' A' ' 107' ' ' ARG . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t -56.5 -31.48 64.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.18 -41.2 92.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -46.37 8.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.897 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.34 113.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.361 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.51 -174.77 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.678 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -179.27 -72.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.06 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -116.09 138.36 51.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.026 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.432 ' HA2' ' CG2' ' A' ' 67' ' ' VAL . . . 141.33 -126.4 3.04 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.691 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 73.29 -62.24 0.47 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.668 0.27 . . . . 0.0 111.264 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 6.6 tt -92.1 41.78 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.85 0.357 . . . . 0.0 111.398 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.432 ' CG2' ' HA2' ' A' ' 64' ' ' GLY . 0.0 OUTLIER -132.32 138.5 32.37 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.189 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.473 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 2.7 Cg_endo -43.23 -50.61 6.4 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.105 2.537 . . . . 0.0 113.088 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 68' ' ' PRO . 57.5 Cg_exo -35.66 151.87 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.044 2.496 . . . . 0.0 113.422 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -56.84 178.72 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.734 2.289 . . . . 0.0 112.575 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.46 -59.97 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.821 2.348 . . . . 0.0 112.467 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.2 72.51 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.22 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -132.47 56.45 1.83 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.839 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.94 176.66 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.814 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 76' ' ' ILE . 0.2 OUTLIER -161.85 30.37 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.091 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 75' ' ' LEU . 0.1 OUTLIER 46.25 -172.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.477 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.402 ' N ' ' CG2' ' A' ' 76' ' ' ILE . . . 124.23 -104.27 0.81 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.589 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 34.4 tpp 68.72 -67.33 0.21 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.819 0.342 . . . . 0.0 110.943 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.9 p -124.96 105.67 9.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.872 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.12 141.51 58.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.7 p -140.48 35.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.98 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.44 129.13 55.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.7 t 63.89 67.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.05 -120.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.456 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -77.27 0.41 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.797 0.332 . . . . 0.0 110.869 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -146.64 171.49 15.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.929 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 t0 59.4 161.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.47 89.98 4.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.9 p -59.14 103.83 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m -108.91 -31.83 7.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.417 ' CB ' HG23 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.504 ' N ' HD13 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.58 HD21 ' O ' ' A' ' 105' ' ' LEU . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.609 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.477 ' O ' ' HE3' ' A' ' 114' ' ' MET . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.573 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.609 ' CG2' ' HA ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.431 ' O ' HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.477 ' HE3' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.573 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.424 ' CZ ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' CZ ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.573 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.732 0.301 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.563 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.818 HD22 ' CG2' ' A' ' 109' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.913 HG21 HG13 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.702 HD12 ' HB2' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' THR . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CB ' HG11 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' CE1' HG21 ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG11 ' CB ' ' A' ' 11' ' ' PRO . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.97 ' CE2' HD22 ' A' ' 101' ' ' LEU . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.913 HG13 HG21 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.592 HG23 ' HG ' ' A' ' 4' ' ' LEU . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 3.5 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 17.7 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 25' ' ' LYS . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.432 HG23 ' HA ' ' A' ' 127' ' ' GLU . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' CD ' ' HB3' ' A' ' 47' ' ' SER . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.441 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.713 ' CD2' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.047 HD13 HG13 ' A' ' 120' ' ' VAL . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HB2' HD13 ' A' ' 50' ' ' LEU . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 52' ' ' LEU . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.731 0.3 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HB3' HG22 ' A' ' 8' ' ' ILE . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.97 HD22 ' CE2' ' A' ' 24' ' ' TYR . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.702 ' HB2' HD12 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.587 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HA ' HG22 ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.85 HG23 ' HE1' ' A' ' 114' ' ' MET . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 1.051 HG12 HD23 ' A' ' 124' ' ' LEU . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.483 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.85 ' HE1' HG23 ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.872 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.047 HG13 HD13 ' A' ' 52' ' ' LEU . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.72 ' HA ' HD22 ' A' ' 115' ' ' LEU . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 1.051 HD23 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.551 ' H ' HD12 ' A' ' 124' ' ' LEU . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.414 ' O ' HG21 ' A' ' 42' ' ' VAL . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 42' ' ' VAL . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.498 ' HE1' HD22 ' A' ' 34' ' ' LEU . 18.3 t80 . . . . . 0 CA--C 1.531 0.224 0 CA-C-O 120.68 0.276 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.613 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.93 HD22 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.819 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.909 HD12 ' HB2' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.671 ' O ' HD12 ' A' ' 14' ' ' ILE . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 12' ' ' GLU . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.645 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG13 ' N ' ' A' ' 12' ' ' GLU . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' H ' HD13 ' A' ' 14' ' ' ILE . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.512 ' CD2' HD12 ' A' ' 101' ' ' LEU . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.869 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.819 HG13 HG21 ' A' ' 6' ' ' VAL . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 40' ' ' PHE . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.819 HG23 HG12 ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 39' ' ' GLN . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.43 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.523 ' O ' HD12 ' A' ' 32' ' ' LEU . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.613 HD13 ' CB ' ' A' ' 3' ' ' ASP . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 2' ' ' PHE . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.638 ' NH2' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 29' ' ' GLN . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 48' ' ' ASP . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.415 ' HG ' ' HB2' ' A' ' 54' ' ' GLU . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' OH ' ' A' ' 104' ' ' TYR . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.786 0.327 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 97' ' ' ARG . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 49' ' ' PHE . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.909 ' HB2' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 56' ' ' LEU . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.598 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.622 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.838 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.93 ' CG2' HD22 ' A' ' 4' ' ' LEU . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 3.3 t-20 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.413 ' O ' ' HG3' ' A' ' 114' ' ' MET . 15.5 m170 -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.752 ' SD ' HD13 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.838 HD11 ' O ' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.559 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.475 ' O ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' CD1' HG12 ' A' ' 109' ' ' VAL . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.452 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.579 ' HB3' HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.796 0.332 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.707 ' H ' HD13 ' A' ' 32' ' ' LEU . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.755 HD12 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' THR . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.704 ' CG2' HG13 ' A' ' 26' ' ' VAL . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.686 HG22 ' HG3' ' A' ' 98' ' ' ARG . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.578 HD13 ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.467 ' N ' HG23 ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.578 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.704 HG13 ' CG2' ' A' ' 6' ' ' VAL . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.627 HG23 ' CD1' ' A' ' 4' ' ' LEU . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.707 HD13 ' H ' ' A' ' 3' ' ' ASP . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.696 HH12 HD12 ' A' ' 124' ' ' LEU . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.595 ' HB1' ' HD3' ' A' ' 25' ' ' LYS . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.408 ' HG3' ' HB2' ' A' ' 21' ' ' TYR . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.862 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.71 ' CD1' HD11 ' A' ' 108' ' ' ILE . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.957 0.408 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 96' ' ' LYS . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 94' ' ' LEU . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.686 ' HG3' HG22 ' A' ' 8' ' ' ILE . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.542 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.573 ' CA ' HD13 ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.676 ' O ' HG13 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.691 ' HA ' HG22 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.605 ' HD2' ' HE1' ' A' ' 114' ' ' MET . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 56' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.755 HG21 HD12 ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.529 ' O ' HD13 ' A' ' 115' ' ' LEU . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.605 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.966 HD23 ' HA ' ' A' ' 121' ' ' ARG . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.862 HG13 HD13 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.966 ' HA ' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.696 HD12 HH12 ' A' ' 36' ' ' ARG . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.628 ' HA ' HD22 ' A' ' 32' ' ' LEU . 37.7 p90 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.836 0.351 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.567 ' H ' HD13 ' A' ' 32' ' ' LEU . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.896 HD12 ' CG2' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.587 HG21 HG13 ' A' ' 26' ' ' VAL . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.57 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.502 HG22 ' HG2' ' A' ' 98' ' ' ARG . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.657 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.588 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.614 HD12 ' O ' ' A' ' 12' ' ' GLU . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.588 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.657 HG13 ' N ' ' A' ' 12' ' ' GLU . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.44 ' N ' ' CG1' ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.649 ' CE2' HD12 ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.587 HG13 HG21 ' A' ' 6' ' ' VAL . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.525 HG23 HD11 ' A' ' 4' ' ' LEU . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.628 HD22 ' HA ' ' A' ' 2' ' ' PHE . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.569 ' O ' HD12 ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.935 ' NH1' HD11 ' A' ' 124' ' ' LEU . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.45 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 29' ' ' GLN . 7.9 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.433 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.614 HG23 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.614 ' HD2' HG23 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' HD12 ' A' ' 50' ' ' LEU . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.436 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.47 ' HE2' HG21 ' A' ' 26' ' ' VAL . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.504 HD23 ' OE2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.86 HD21 ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.504 ' OE2' HD23 ' A' ' 50' ' ' LEU . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.687 HD23 ' NH1' ' A' ' 107' ' ' ARG . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.862 0.363 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 94' ' ' LEU . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.502 ' HG2' HG22 ' A' ' 8' ' ' ILE . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.649 HD12 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.499 ' N ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.509 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.3 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.687 ' NH1' HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.72 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.896 ' CG2' HD12 ' A' ' 4' ' ' LEU . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 2.4 m-20 -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.402 ' HA ' HD23 ' A' ' 115' ' ' LEU . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.619 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 115' ' ' LEU . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.462 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.77 HG23 HD13 ' A' ' 52' ' ' LEU . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.86 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HG2' HG12 ' A' ' 42' ' ' VAL . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.935 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 1.8 t80 . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 119.969 -0.063 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.859 HD22 HG21 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.863 HG22 ' HA ' ' A' ' 28' ' ' THR . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.583 HD12 ' N ' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.447 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.639 HG21 ' CE1' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.639 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 12' ' ' GLU . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.932 ' CE2' HD22 ' A' ' 101' ' ' LEU . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.623 HG13 HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.863 ' HA ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.734 HG21 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' CD2' ' CB ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.935 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.734 ' HB2' HG21 ' A' ' 30' ' ' THR . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' GLN . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.885 ' CD1' HD11 ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 54' ' ' GLU . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.023 HD13 HG13 ' A' ' 120' ' ' VAL . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 50' ' ' LEU . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.719 HD12 ' OH ' ' A' ' 104' ' ' TYR . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.825 0.345 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.932 HD22 ' CE2' ' A' ' 24' ' ' TYR . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.583 ' N ' HD12 ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.719 ' OH ' HD12 ' A' ' 56' ' ' LEU . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.718 ' O ' HG22 ' A' ' 109' ' ' VAL . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.638 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.956 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.859 HG21 HD22 ' A' ' 4' ' ' LEU . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 34.0 t60 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.442 ' HB ' ' CD2' ' A' ' 111' ' ' HIS . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.956 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.624 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.023 HG13 HD13 ' A' ' 52' ' ' LEU . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.644 ' HA ' HD22 ' A' ' 115' ' ' LEU . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.542 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.757 HD13 HG12 ' A' ' 109' ' ' VAL . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.468 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.809 0.338 . . . . 0.0 110.926 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.62 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.695 HG22 ' HB2' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.85 ' HB2' HG11 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' HG13 ' A' ' 22' ' ' VAL . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.521 ' C ' HD13 ' A' ' 14' ' ' ILE . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.87 HD11 ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.85 HG11 ' HB2' ' A' ' 11' ' ' PRO . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.87 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.537 HG23 ' HB2' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.62 HD13 ' CB ' ' A' ' 3' ' ' ASP . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.468 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB2' HG23 ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' HB1' ' A' ' 23' ' ' ALA . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.063 HD13 HG13 ' A' ' 120' ' ' VAL . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.414 ' HD2' HD13 ' A' ' 50' ' ' LEU . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.459 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.743 0.306 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.695 ' HB2' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.6 ' CA ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.561 HD23 HG11 ' A' ' 6' ' ' VAL . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.613 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.804 HG23 ' HG ' ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 4' ' ' LEU . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 106' ' ' GLN . 5.0 m-20 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.472 ' O ' ' HG2' ' A' ' 114' ' ' MET . 2.2 t-80 -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.878 ' O ' HD22 ' A' ' 115' ' ' LEU . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' ' O ' ' A' ' 111' ' ' HIS . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.878 HD22 ' O ' ' A' ' 112' ' ' PRO . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 118' ' ' PRO . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.063 HG13 HD13 ' A' ' 52' ' ' LEU . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.666 ' HD2' HD23 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.6 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 125' ' ' GLU . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.618 ' HB2' HD12 ' A' ' 124' ' ' LEU . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.669 ' O ' HD23 ' A' ' 32' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.861 0.362 . . . . 0.0 111.265 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB3' HD23 ' A' ' 32' ' ' LEU . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.742 HD22 ' CB ' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.797 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.719 HG22 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.414 ' O ' ' O ' ' A' ' 9' ' ' THR . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.839 ' HB2' HG11 ' A' ' 22' ' ' VAL . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.637 ' C ' HD12 ' A' ' 14' ' ' ILE . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 13' ' ' LYS . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.839 HG11 ' HB2' ' A' ' 11' ' ' PRO . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.522 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.598 ' NZ ' ' HB1' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.797 HG13 HG21 ' A' ' 6' ' ' VAL . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.722 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.602 HG22 ' HG3' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.491 HD23 HD12 ' A' ' 32' ' ' LEU . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.602 ' HG3' HG22 ' A' ' 30' ' ' THR . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.598 ' HB1' ' NZ ' ' A' ' 25' ' ' LYS . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.429 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.648 ' CZ ' HG21 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.676 HD21 ' OE2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.059 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.676 ' OE2' HD21 ' A' ' 50' ' ' LEU . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 52' ' ' LEU . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t . . . . . 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.75 0.309 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HG2' ' A' ' 11' ' ' PRO . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.719 ' HG2' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.522 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.527 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.644 ' CE1' HD11 ' A' ' 108' ' ' ILE . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.69 HD22 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.678 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.906 ' HA ' ' HE3' ' A' ' 114' ' ' MET . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.742 ' CB ' HD22 ' A' ' 4' ' ' LEU . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.459 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.906 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.554 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.059 HG13 HD13 ' A' ' 52' ' ' LEU . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.882 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.567 HD22 HG12 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.408 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.809 ' HA ' HD21 ' A' ' 32' ' ' LEU . 39.8 p90 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.821 0.343 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.793 HD22 ' CB ' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.779 HG11 ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.859 HD12 ' N ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.498 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.854 ' HB2' HG11 ' A' ' 22' ' ' VAL . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' HG13 ' A' ' 22' ' ' VAL . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 23' ' ' ALA . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.544 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.854 HG11 ' HB2' ' A' ' 11' ' ' PRO . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB2' HD11 ' A' ' 14' ' ' ILE . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.787 ' CE2' HD12 ' A' ' 101' ' ' LEU . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.743 HG12 HG12 ' A' ' 8' ' ' ILE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.662 HG23 HD21 ' A' ' 4' ' ' LEU . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.822 HG23 ' HG3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.009 HD22 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.822 ' HG3' HG23 ' A' ' 30' ' ' THR . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.646 HG13 HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.679 ' CD2' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.88 HD13 HG23 ' A' ' 120' ' ' VAL . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.421 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.845 0.355 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.421 HD23 ' HG2' ' A' ' 11' ' ' PRO . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.565 ' NH1' ' HB2' ' A' ' 99' ' ' ALA . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . 0.565 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.787 HD12 ' CE2' ' A' ' 24' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.859 ' N ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.779 ' CD2' HG11 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.785 HG21 ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.93 HG12 ' CD2' ' A' ' 124' ' ' LEU . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.4 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 50.0 m170 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.67 HD22 HG23 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.471 ' CB ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.88 HG23 HD13 ' A' ' 52' ' ' LEU . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.609 ' CD2' HD11 ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.93 ' CD2' HG12 ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.816 ' CE1' HD22 ' A' ' 34' ' ' LEU . 2.9 t80 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.656 0.265 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.709 ' HB2' HD13 ' A' ' 32' ' ' LEU . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.702 HD22 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.806 HG21 HG13 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.553 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.581 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HE3' ' HB3' ' A' ' 20' ' ' ALA . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.869 ' O ' ' HB1' ' A' ' 20' ' ' ALA . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.431 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.438 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.469 ' HD2' HD12 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.86 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.806 HG13 HG21 ' A' ' 6' ' ' VAL . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.548 HG21 HD11 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' THR . 2.1 pm0 -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.726 HD22 ' O ' ' A' ' 2' ' ' PHE . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.816 HD22 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.418 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.86 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.607 HG21 ' HB2' ' A' ' 125' ' ' GLU . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.449 ' CE1' ' CD2' ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.956 HD13 HG13 ' A' ' 120' ' ' VAL . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.847 0.356 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.581 ' N ' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 105' ' ' LEU . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.421 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.956 HG13 HD13 ' A' ' 52' ' ' LEU . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.502 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.626 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.685 HD13 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.607 ' HB2' HG21 ' A' ' 42' ' ' VAL . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 123' ' ' PHE . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.567 ' HE1' HD13 ' A' ' 34' ' ' LEU . 22.7 t80 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 110.742 -0.095 . . . . 0.0 110.742 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.746 HD11 ' CG2' ' A' ' 28' ' ' THR . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 5' ' ' THR . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.539 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.45 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.444 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.409 ' N ' ' CG2' ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.517 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.885 HG23 ' HB ' ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.589 ' O ' HG22 ' A' ' 27' ' ' THR . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.746 ' CG2' HD11 ' A' ' 4' ' ' LEU . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 3' ' ' ASP . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' HE1' ' A' ' 2' ' ' PHE . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.412 HH12 HD11 ' A' ' 124' ' ' LEU . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.885 ' HB ' HG23 ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.075 HD13 HG13 ' A' ' 120' ' ' VAL . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' A' ' 56' ' ' LEU . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.843 0.354 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.427 ' CD ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.804 ' HB2' HD12 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.956 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.641 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.629 ' HG2' HD13 ' A' ' 108' ' ' ILE . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.956 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.939 HG22 ' O ' ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 0.1 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.476 ' HE2' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.552 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.075 HG13 HD13 ' A' ' 52' ' ' LEU . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.417 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' PHE . . . . . 0.747 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.717 HD22 HG13 ' A' ' 109' ' ' VAL . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.746 0.308 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -157.65 24.81 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.563 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.818 HD22 ' CG2' ' A' ' 109' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.913 HG21 HG13 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.702 HD12 ' HB2' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' THR . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CB ' HG11 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' CE1' HG21 ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG11 ' CB ' ' A' ' 11' ' ' PRO . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.97 ' CE2' HD22 ' A' ' 101' ' ' LEU . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.913 HG13 HG21 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.592 HG23 ' HG ' ' A' ' 4' ' ' LEU . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 3.5 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 17.7 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 25' ' ' LYS . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.432 HG23 ' HA ' ' A' ' 127' ' ' GLU . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' CD ' ' HB3' ' A' ' 47' ' ' SER . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.441 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.713 ' CD2' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.047 HD13 HG13 ' A' ' 120' ' ' VAL . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 68' ' ' PRO . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HB2' HD13 ' A' ' 50' ' ' LEU . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 52' ' ' LEU . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -31.96 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.93 -25.43 11.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.554 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -24.02 11.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.601 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.05 -176.11 1.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.869 0.366 . . . . 0.0 111.107 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.0 p -116.82 -33.49 4.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.326 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.53 -66.54 0.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -84.78 153.13 23.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.037 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.39 55.51 2.19 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.666 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 55.47 87.5 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 0.0 110.942 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.464 ' O ' HG13 ' A' ' 66' ' ' ILE . 5.8 tp -98.4 35.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.622 ' O ' HG13 ' A' ' 67' ' ' VAL . 7.6 p -132.31 98.46 16.92 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.335 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 41.1 Cg_exo -55.94 -43.57 55.63 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.454 2.103 . . . . 0.0 112.128 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 72.7 Cg_exo -51.01 -167.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.816 2.344 . . . . 0.0 112.231 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.509 ' CD ' ' CB ' ' A' ' 69' ' ' PRO . 80.3 Cg_exo -46.01 173.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.451 2.101 . . . . 0.0 112.712 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.415 ' HG3' ' CD ' ' A' ' 107' ' ' ARG . 82.2 Cg_exo -43.1 -38.92 7.83 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.754 2.302 . . . . 0.0 112.552 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -138.63 179.9 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.83 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -64.35 103.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.908 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.75 41.61 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.938 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 75' ' ' LEU . 3.1 mt 68.88 -65.43 0.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.024 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -50.4 -41.29 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.256 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' N ' HG23 ' A' ' 76' ' ' ILE . . . -55.36 -94.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.601 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.468 ' HE1' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -115.81 129.58 56.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 110.98 179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 70.2 m -163.99 -60.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.863 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.48 38.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.849 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.481 HG23 ' N ' ' A' ' 82' ' ' LYS . 23.6 m -57.72 -45.96 86.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.245 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.481 ' N ' HG23 ' A' ' 81' ' ' VAL . 2.3 mtpp 67.38 -69.41 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.4 m -61.6 -179.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.302 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.06 -78.66 0.51 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.463 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -170.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.951 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -72.07 150.06 44.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -140.87 -47.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.853 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.5 p 62.55 122.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.016 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.9 m -103.18 -31.31 10.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p -150.49 172.14 15.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HB3' HG22 ' A' ' 8' ' ' ILE . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.522 ' CB ' HD12 ' A' ' 76' ' ' ILE . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.97 HD22 ' CE2' ' A' ' 24' ' ' TYR . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.702 ' HB2' HD12 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.445 ' HB2' ' HG3' ' A' ' 70' ' ' PRO . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.587 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HA ' HG22 ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.415 ' CD ' ' HG3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.85 HG23 ' HE1' ' A' ' 114' ' ' MET . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 1.051 HG12 HD23 ' A' ' 124' ' ' LEU . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.483 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.85 ' HE1' HG23 ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.872 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.047 HG13 HD13 ' A' ' 52' ' ' LEU . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.72 ' HA ' HD22 ' A' ' 115' ' ' LEU . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 1.051 HD23 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.551 ' H ' HD12 ' A' ' 124' ' ' LEU . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.414 ' O ' HG21 ' A' ' 42' ' ' VAL . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 42' ' ' VAL . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.498 ' HE1' HD22 ' A' ' 34' ' ' LEU . 18.3 t80 -92.2 8.06 39.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.192 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.613 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.93 HD22 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.819 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.909 HD12 ' HB2' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.671 ' O ' HD12 ' A' ' 14' ' ' ILE . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 12' ' ' GLU . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.645 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG13 ' N ' ' A' ' 12' ' ' GLU . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' H ' HD13 ' A' ' 14' ' ' ILE . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.512 ' CD2' HD12 ' A' ' 101' ' ' LEU . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.869 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.819 HG13 HG21 ' A' ' 6' ' ' VAL . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 40' ' ' PHE . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.819 HG23 HG12 ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 39' ' ' GLN . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.43 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.523 ' O ' HD12 ' A' ' 32' ' ' LEU . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.613 HD13 ' CB ' ' A' ' 3' ' ' ASP . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 2' ' ' PHE . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.638 ' NH2' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 29' ' ' GLN . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 48' ' ' ASP . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.415 ' HG ' ' HB2' ' A' ' 54' ' ' GLU . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' OH ' ' A' ' 104' ' ' TYR . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t -58.17 -38.15 76.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.96 -44.2 66.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.79 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mmpm? -61.86 -25.73 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.084 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 65.04 -76.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.6 m -137.41 172.66 12.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.907 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -174.31 136.83 0.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -100.42 153.13 19.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.847 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.93 12.17 4.55 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.867 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.656 ' C ' HD12 ' A' ' 66' ' ' ILE . 2.6 m-85 -108.53 63.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.797 0.332 . . . . 0.0 110.557 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.656 HD12 ' C ' ' A' ' 65' ' ' PHE . 3.6 mp 69.99 -65.61 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.852 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.825 HG12 ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -99.76 146.26 31.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.58 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.825 ' HD2' HG12 ' A' ' 67' ' ' VAL . 52.3 Cg_exo -52.07 -45.31 39.78 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.552 2.168 . . . . 0.0 112.783 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 73.7 Cg_exo -50.39 145.23 21.97 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.398 2.066 . . . . 0.0 112.338 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.18 172.39 0.3 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 112.442 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.28 -48.37 22.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.712 2.275 . . . . 0.0 112.274 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -178.02 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.981 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.9 15.7 1.91 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.325 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 75' ' ' LEU . 5.3 p 67.56 -64.94 0.25 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.297 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.445 ' N ' ' OG ' ' A' ' 74' ' ' SER . 0.9 OUTLIER 59.84 39.61 20.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 0.0 110.824 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.608 HG23 ' O ' ' A' ' 76' ' ' ILE . 8.6 tp -151.12 55.14 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.035 0.445 . . . . 0.0 111.101 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.88 36.79 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.649 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 18.9 mmt -133.1 94.88 3.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 110.867 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.81 -165.91 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -57.51 163.15 2.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.964 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.21 -46.39 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.406 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.719 ' O ' HG22 ' A' ' 83' ' ' VAL . 0.1 OUTLIER -171.07 -144.45 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.898 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.719 HG22 ' O ' ' A' ' 82' ' ' LYS . 11.0 m 53.75 164.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.069 0.462 . . . . 0.0 111.781 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.73 95.75 0.33 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.344 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -54.28 105.56 0.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.848 0.356 . . . . 0.0 111.08 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -138.64 121.95 17.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.865 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.7 t0 63.79 136.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 11.2 m -161.74 72.0 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.774 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.3 t 59.49 66.28 1.04 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.763 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m -124.0 135.0 53.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.957 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 97' ' ' ARG . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 49' ' ' PHE . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.909 ' HB2' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 56' ' ' LEU . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.598 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.622 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.838 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.93 ' CG2' HD22 ' A' ' 4' ' ' LEU . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 12.8 t30 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.413 ' O ' ' HG3' ' A' ' 114' ' ' MET . 0.3 OUTLIER -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.752 ' SD ' HD13 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.838 HD11 ' O ' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.559 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.475 ' O ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' CD1' HG12 ' A' ' 109' ' ' VAL . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.452 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.878 0.371 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.579 ' HB3' HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -111.09 -171.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.73 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.707 ' H ' HD13 ' A' ' 32' ' ' LEU . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.755 HD12 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' THR . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.704 ' CG2' HG13 ' A' ' 26' ' ' VAL . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.686 HG22 ' HG3' ' A' ' 98' ' ' ARG . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.578 HD13 ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.467 ' N ' HG23 ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.578 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.704 HG13 ' CG2' ' A' ' 6' ' ' VAL . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.627 HG23 ' CD1' ' A' ' 4' ' ' LEU . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.707 HD13 ' H ' ' A' ' 3' ' ' ASP . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.696 HH12 HD12 ' A' ' 124' ' ' LEU . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.595 ' HB1' ' HD3' ' A' ' 25' ' ' LYS . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.408 ' HG3' ' HB2' ' A' ' 21' ' ' TYR . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.862 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' O ' ' CB ' ' A' ' 58' ' ' GLU . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.71 ' CD1' HD11 ' A' ' 108' ' ' ILE . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -76.18 -44.13 39.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 54' ' ' GLU . 42.3 tt0 -61.34 -25.75 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.448 ' O ' ' N ' ' A' ' 61' ' ' SER . 2.6 mtpm? -83.51 -37.96 22.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.477 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 44.39 -90.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.297 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 59' ' ' LYS . 14.2 p 58.13 163.3 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 0.0 111.186 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.7 -73.24 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.2 150.23 37.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.035 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -154.72 -44.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.62 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.418 ' CD2' ' CG ' ' A' ' 114' ' ' MET . 4.1 m-85 -103.07 152.06 21.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.801 0.334 . . . . 0.0 110.856 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 pt -65.13 -30.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.096 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.656 HG22 ' HD2' ' A' ' 69' ' ' PRO . 14.7 p -62.92 112.74 7.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.473 ' HB2' ' HD3' ' A' ' 69' ' ' PRO . 27.5 Cg_exo -59.17 -49.96 9.77 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.049 1.833 . . . . 0.0 112.271 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.656 ' HD2' HG22 ' A' ' 67' ' ' VAL . 39.2 Cg_exo -60.14 143.38 99.54 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.152 1.901 . . . . 0.0 111.665 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -51.59 178.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.278 1.985 . . . . 0.0 112.194 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.468 ' HB3' ' HD3' ' A' ' 107' ' ' ARG . 80.7 Cg_exo -46.15 -65.41 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.657 2.238 . . . . 0.0 112.17 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -179.55 106.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.74 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.74 138.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.971 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -113.39 108.52 17.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.66 167.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.062 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.486 HD12 ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -130.72 -44.33 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.923 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.6 -105.53 3.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.654 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -85.91 156.54 20.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.767 0.318 . . . . 0.0 110.935 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.824 HG21 ' OE2' ' A' ' 95' ' ' GLU . 2.0 p -79.93 -43.73 21.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp 60.82 157.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.901 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.4 m 41.79 72.42 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.678 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -167.75 154.89 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.3 t -111.45 -41.35 4.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 113.49 63.28 0.43 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -103.15 67.23 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.875 0.369 . . . . 0.0 110.858 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.22 -179.95 5.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.809 ' O ' ' HB2' ' A' ' 91' ' ' ALA . 2.3 m-20 -54.37 173.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.8 -28.56 11.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 39.6 p -57.43 -30.72 65.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.05 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p -170.93 67.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.832 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 87' ' ' ASP . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 96' ' ' LYS . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 94' ' ' LEU . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.824 ' OE2' HG21 ' A' ' 79' ' ' THR . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.486 ' HD2' HD12 ' A' ' 76' ' ' ILE . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.686 ' HG3' HG22 ' A' ' 8' ' ' ILE . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.542 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.573 ' CA ' HD13 ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.676 ' O ' HG13 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.691 ' HA ' HG22 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.605 ' HD2' ' HE1' ' A' ' 114' ' ' MET . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 56' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.755 HG21 HD12 ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.529 ' O ' HD13 ' A' ' 115' ' ' LEU . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.605 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.966 HD23 ' HA ' ' A' ' 121' ' ' ARG . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.862 HG13 HD13 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.966 ' HA ' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.696 HD12 HH12 ' A' ' 36' ' ' ARG . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.789 0.328 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.628 ' HA ' HD22 ' A' ' 32' ' ' LEU . 37.7 p90 -145.07 141.66 29.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.051 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.567 ' H ' HD13 ' A' ' 32' ' ' LEU . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.896 HD12 ' CG2' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.587 HG21 HG13 ' A' ' 26' ' ' VAL . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.57 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.502 HG22 ' HG2' ' A' ' 98' ' ' ARG . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.657 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.588 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.614 HD12 ' O ' ' A' ' 12' ' ' GLU . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.588 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.657 HG13 ' N ' ' A' ' 12' ' ' GLU . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.44 ' N ' ' CG1' ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.649 ' CE2' HD12 ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.587 HG13 HG21 ' A' ' 6' ' ' VAL . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.525 HG23 HD11 ' A' ' 4' ' ' LEU . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.628 HD22 ' HA ' ' A' ' 2' ' ' PHE . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.569 ' O ' HD12 ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.935 ' NH1' HD11 ' A' ' 124' ' ' LEU . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.45 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 29' ' ' GLN . 7.9 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.433 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.614 HG23 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.614 ' HD2' HG23 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' HD12 ' A' ' 50' ' ' LEU . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.436 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.47 ' HE2' HG21 ' A' ' 26' ' ' VAL . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.504 HD23 ' OE2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.86 HD21 ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.504 ' OE2' HD23 ' A' ' 50' ' ' LEU . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.687 HD23 ' NH1' ' A' ' 107' ' ' ARG . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m -69.33 -34.08 74.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -74.98 -42.76 56.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.811 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.7 tpmp? -75.11 -43.24 53.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.4 ' ND1' ' HE3' ' A' ' 73' ' ' LYS . 1.0 OUTLIER 66.52 -72.16 0.09 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m -67.25 -51.37 53.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.84 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.86 96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.787 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -59.38 116.95 4.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.83 -55.87 0.64 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.596 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.586 ' CE2' ' HG2' ' A' ' 114' ' ' MET . 4.0 t80 -110.05 126.24 53.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.873 0.368 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.658 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -143.26 41.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.841 179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -76.53 123.65 87.75 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.125 -179.729 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.559 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 17.4 Cg_endo -63.34 -30.08 72.88 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.568 2.179 . . . . 0.0 114.625 -179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 67' ' ' VAL . 74.8 Cg_exo -48.87 -169.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.346 2.031 . . . . 0.0 112.819 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.509 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 86.6 Cg_exo -42.28 -45.99 7.6 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.72 2.28 . . . . 0.0 114.048 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.591 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 74.5 Cg_exo -49.18 89.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.161 1.908 . . . . 0.0 112.512 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 70' ' ' PRO . 3.1 pt-20 -167.86 -177.12 3.3 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.719 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HE3' ' ND1' ' A' ' 60' ' ' HIS . 0.5 OUTLIER -95.54 -31.87 13.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.7 t -65.13 78.97 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 tt -176.29 -52.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 76' ' ' ILE . 17.7 tt -155.34 97.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.66 -66.36 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.409 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.7 mtm 61.27 28.51 18.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 0.0 111.198 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.63 -152.82 0.39 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.713 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.8 85.78 0.11 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.909 0.385 . . . . 0.0 110.931 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.1 m -103.99 143.64 15.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.047 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt 59.58 63.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.711 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 83' ' ' VAL . 12.8 p -57.6 123.63 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -125.33 11.35 7.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.839 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -62.99 104.59 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.793 0.33 . . . . 0.0 110.881 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 153.9 19.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.947 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -172.03 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.9 t -171.4 -70.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.902 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.4 t -163.34 -171.5 2.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -166.52 91.73 0.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.931 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 94' ' ' LEU . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.502 ' HG2' HG22 ' A' ' 8' ' ' ILE . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.649 HD12 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.499 ' N ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.509 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.3 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.687 ' NH1' HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.72 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.896 ' CG2' HD12 ' A' ' 4' ' ' LEU . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 2.4 m-20 -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.402 ' HA ' HD23 ' A' ' 115' ' ' LEU . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.619 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 115' ' ' LEU . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.462 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.77 HG23 HD13 ' A' ' 52' ' ' LEU . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.86 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HG2' HG12 ' A' ' 42' ' ' VAL . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.816 0.341 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.935 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 1.8 t80 57.71 -111.8 0.61 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.859 HD22 HG21 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.863 HG22 ' HA ' ' A' ' 28' ' ' THR . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.583 HD12 ' N ' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.447 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.639 HG21 ' CE1' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.639 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 12' ' ' GLU . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.932 ' CE2' HD22 ' A' ' 101' ' ' LEU . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.623 HG13 HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.863 ' HA ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.734 HG21 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' CD2' ' CB ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.935 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.734 ' HB2' HG21 ' A' ' 30' ' ' THR . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' GLN . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.885 ' CD1' HD11 ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 54' ' ' GLU . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.023 HD13 HG13 ' A' ' 120' ' ' VAL . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 50' ' ' LEU . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.719 HD12 ' OH ' ' A' ' 104' ' ' TYR . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t -76.13 -31.58 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -52.61 -25.35 10.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.64 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -53.64 -23.96 12.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.676 0.274 . . . . 0.0 111.227 -179.6 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.44 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 6.5 m80 54.05 96.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.157 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.3 m -164.54 164.17 21.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.954 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -85.37 -54.16 4.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 19.7 p30 -61.33 153.29 27.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.816 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -53.4 -28.72 36.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.1 OUTLIER 177.69 -166.5 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.831 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.625 HD12 ' O ' ' A' ' 66' ' ' ILE . 2.0 pp -110.16 32.65 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.945 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.474 HG22 ' HB3' ' A' ' 65' ' ' PHE . 0.3 OUTLIER -125.03 159.0 61.14 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.039 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.584 ' HB2' ' HD2' ' A' ' 70' ' ' PRO . 11.2 Cg_endo -55.35 -175.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.584 2.19 . . . . 0.0 112.364 -179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' A' ' 68' ' ' PRO . 39.2 Cg_exo -61.15 -46.49 15.31 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.866 2.378 . . . . 0.0 114.405 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' ' HB2' ' A' ' 68' ' ' PRO . 36.6 Cg_exo -57.67 -53.29 4.72 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.143 1.896 . . . . 0.0 113.164 -178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' A' ' 70' ' ' PRO . 51.8 Cg_exo -54.76 -22.33 28.93 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.01 1.807 . . . . 0.0 112.221 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -86.81 -73.83 0.45 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.994 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 tptp 54.19 -102.1 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.787 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.697 ' C ' HD23 ' A' ' 75' ' ' LEU . 0.0 OUTLIER 46.35 -169.07 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.831 0.348 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.709 HD11 ' HD2' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -166.08 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.675 HG22 ' O ' ' A' ' 75' ' ' LEU . 1.9 tt 50.95 169.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.46 20.58 36.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.778 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.652 ' H ' HG23 ' A' ' 76' ' ' ILE . 7.6 mmm 61.73 116.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 49.55 77.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.44 133.86 53.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.175 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.53 HG13 ' N ' ' A' ' 82' ' ' LYS . 6.7 p -175.32 -52.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.874 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.53 ' N ' HG13 ' A' ' 81' ' ' VAL . 6.0 tptt 51.67 173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.951 0.405 . . . . 0.0 111.717 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.731 HG12 ' H ' ' A' ' 85' ' ' LYS . 58.0 t 53.85 -83.73 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.619 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 82' ' ' LYS . . . 120.26 -26.24 7.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.731 ' H ' HG12 ' A' ' 83' ' ' VAL . 8.6 mmmt -110.56 -167.79 1.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.824 0.345 . . . . 0.0 110.85 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -85.28 133.14 34.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.553 ' OD1' HG11 ' A' ' 83' ' ' VAL . 4.0 p-10 -173.5 105.06 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p 67.01 11.95 8.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.569 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.3 m 46.13 30.19 0.92 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.838 0.351 . . . . 0.0 111.228 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 62.94 37.35 12.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.932 HD22 ' CE2' ' A' ' 24' ' ' TYR . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.583 ' N ' HD12 ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HD2' HD11 ' A' ' 75' ' ' LEU . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.719 ' OH ' HD12 ' A' ' 56' ' ' LEU . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.718 ' O ' HG22 ' A' ' 109' ' ' VAL . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.638 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.956 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.859 HG21 HD22 ' A' ' 4' ' ' LEU . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 34.0 t60 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.442 ' HB ' ' CD2' ' A' ' 111' ' ' HIS . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.956 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.624 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.023 HG13 HD13 ' A' ' 52' ' ' LEU . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.644 ' HA ' HD22 ' A' ' 115' ' ' LEU . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.542 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.757 HD13 HG12 ' A' ' 109' ' ' VAL . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.832 0.348 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.468 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -127.81 -166.43 1.61 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.926 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.62 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.695 HG22 ' HB2' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.85 ' HB2' HG11 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' HG13 ' A' ' 22' ' ' VAL . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.521 ' C ' HD13 ' A' ' 14' ' ' ILE . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.87 HD11 ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.85 HG11 ' HB2' ' A' ' 11' ' ' PRO . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.87 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.537 HG23 ' HB2' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.62 HD13 ' CB ' ' A' ' 3' ' ' ASP . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.468 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB2' HG23 ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' HB1' ' A' ' 23' ' ' ALA . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.063 HD13 HG13 ' A' ' 120' ' ' VAL . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.414 ' HD2' HD13 ' A' ' 50' ' ' LEU . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.459 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -76.14 -32.94 59.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.88 -37.52 86.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.217 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' O ' ' N ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -59.11 -46.43 88.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.009 -179.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 m80 42.85 -92.68 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.428 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 59' ' ' LYS . 3.2 m 45.91 78.05 0.07 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 111.479 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.0 -158.88 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.82 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -41.89 153.44 0.06 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.427 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -37.77 -91.93 0.01 OUTLIER Glycine 0 C--N 1.333 0.367 0 CA-C-N 116.09 -0.504 . . . . 0.0 113.272 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.624 ' C ' HD12 ' A' ' 66' ' ' ILE . 0.5 OUTLIER -114.19 -79.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.581 0.229 . . . . 0.0 110.966 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.624 HD12 ' C ' ' A' ' 65' ' ' PHE . 4.2 mp -148.87 -59.71 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.756 0.312 . . . . 0.0 111.188 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.657 HG23 ' CG ' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -113.79 126.6 27.86 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.494 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 36.3 Cg_exo -58.52 -41.22 67.07 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.843 2.362 . . . . 0.0 113.97 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.502 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 52.3 Cg_exo -53.08 -56.81 2.44 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.414 2.076 . . . . 0.0 114.23 -178.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.657 ' CG ' HG23 ' A' ' 67' ' ' VAL . 6.1 Cg_exo -45.95 -57.55 2.13 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 121.873 1.716 . . . . 0.0 112.678 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.505 ' HD3' ' CB ' ' A' ' 70' ' ' PRO . 50.8 Cg_exo -50.76 -164.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.365 2.043 . . . . 0.0 112.478 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.47 ' HG2' ' HD2' ' A' ' 107' ' ' ARG . 1.5 pp20? -102.65 -156.59 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.546 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HD2' HG23 ' A' ' 76' ' ' ILE . 0.1 OUTLIER -49.04 177.41 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.001 0.429 . . . . 0.0 111.457 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -55.41 5.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.707 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 75' ' ' LEU . 6.9 tp 179.51 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.622 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.4 HG23 ' HD2' ' A' ' 73' ' ' LYS . 16.4 pt 44.14 87.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 111.66 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 172.35 141.85 3.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.3 mtp 62.73 31.35 16.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.931 0.396 . . . . 0.0 110.881 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.62 -78.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -110.74 -24.35 10.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.171 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.61 178.12 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.298 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.98 22.28 7.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.176 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.6 t 68.01 -68.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.182 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 101.25 -153.5 19.0 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.496 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.71 30.23 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -153.03 125.27 8.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.799 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.67 -167.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.2 t 66.66 108.24 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.952 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.4 m 60.91 88.42 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t -152.97 23.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.115 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.695 ' HB2' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.6 ' CA ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.561 HD23 HG11 ' A' ' 6' ' ' VAL . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.613 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.804 HG23 ' HG ' ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 4' ' ' LEU . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 106' ' ' GLN . 5.0 m-20 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.472 ' O ' ' HG2' ' A' ' 114' ' ' MET . 2.2 t-80 -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.878 ' O ' HD22 ' A' ' 115' ' ' LEU . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.64 ' HE2' ' HA ' ' A' ' 108' ' ' ILE . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.878 HD22 ' O ' ' A' ' 112' ' ' PRO . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 118' ' ' PRO . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.063 HG13 HD13 ' A' ' 52' ' ' LEU . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.666 ' HD2' HD23 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.6 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 125' ' ' GLU . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.618 ' HB2' HD12 ' A' ' 124' ' ' LEU . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.771 0.319 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.669 ' O ' HD23 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -156.98 -42.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.265 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB3' HD23 ' A' ' 32' ' ' LEU . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.742 HD22 ' CB ' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.797 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.719 HG22 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.414 ' O ' ' O ' ' A' ' 9' ' ' THR . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.839 ' HB2' HG11 ' A' ' 22' ' ' VAL . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.637 ' C ' HD12 ' A' ' 14' ' ' ILE . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 13' ' ' LYS . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.839 HG11 ' HB2' ' A' ' 11' ' ' PRO . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.522 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.598 ' NZ ' ' HB1' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.797 HG13 HG21 ' A' ' 6' ' ' VAL . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.722 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.602 HG22 ' HG3' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.491 HD23 HD12 ' A' ' 32' ' ' LEU . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.602 ' HG3' HG22 ' A' ' 30' ' ' THR . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.598 ' HB1' ' NZ ' ' A' ' 25' ' ' LYS . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.429 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.648 ' CZ ' HG21 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.676 HD21 ' OE2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.059 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.676 ' OE2' HD21 ' A' ' 50' ' ' LEU . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 52' ' ' LEU . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t -76.22 -44.36 37.95 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.423 ' HG2' ' HA ' ' A' ' 55' ' ' LYS . 5.7 pt-20 -75.05 -48.2 25.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.8 OUTLIER -57.04 -46.21 82.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.194 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 1.0 OUTLIER 178.54 102.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.167 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.94 137.57 36.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 62.7 -131.64 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.486 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -50.58 117.11 2.24 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.853 0.358 . . . . 0.0 111.205 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.64 42.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.517 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.49 ' N ' ' CD1' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -165.68 88.38 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.676 0.274 . . . . 0.0 111.092 -179.877 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.538 ' CD1' HG22 ' A' ' 113' ' ' THR . 0.5 OUTLIER 42.07 -89.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.854 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.615 HG22 ' HD2' ' A' ' 69' ' ' PRO . 10.9 p -62.5 109.7 2.62 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 120.397 0.142 . . . . 0.0 111.123 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.445 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 4.6 Cg_exo -42.6 -54.22 3.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.867 2.378 . . . . 0.0 112.975 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.615 ' HD2' HG22 ' A' ' 67' ' ' VAL . 63.2 Cg_exo -36.9 112.81 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.056 2.504 . . . . 0.0 113.177 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' CB ' ' CD ' ' A' ' 71' ' ' PRO . 63.2 Cg_exo -51.82 -175.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.699 2.266 . . . . 0.0 112.402 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.421 ' O ' ' N ' ' A' ' 73' ' ' LYS . 14.9 Cg_exo -68.93 58.18 1.15 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.866 2.377 . . . . 0.0 112.646 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 50.45 -88.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.492 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -123.83 -172.93 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.11 -79.19 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.67 100.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 76' ' ' ILE . 10.3 tt -149.22 46.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.977 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.0 101.9 0.85 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.48 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 1.6 ptp -115.27 -38.42 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.843 0.354 . . . . 0.0 110.923 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -151.72 -79.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.01 171.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.572 HG13 ' O ' ' A' ' 81' ' ' VAL . 9.6 p -178.42 65.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.053 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -116.95 134.77 54.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.093 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 84' ' ' GLY . 11.1 p -168.24 156.22 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.446 ' N ' HG22 ' A' ' 83' ' ' VAL . . . 127.81 -48.77 0.95 Allowed Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.2 73.33 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.819 0.342 . . . . 0.0 110.887 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -140.02 125.9 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -80.68 60.83 4.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.737 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 3.5 m -83.97 -19.75 34.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.042 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.54 99.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.86 0.362 . . . . 0.0 111.045 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m 61.07 35.51 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.109 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.737 ' HB2' ' CB ' ' A' ' 88' ' ' SER . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HG2' ' A' ' 11' ' ' PRO . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.719 ' HG2' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.522 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.527 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.644 ' CE1' HD11 ' A' ' 108' ' ' ILE . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.69 HD22 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.678 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.906 ' HA ' ' HE3' ' A' ' 114' ' ' MET . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.742 ' CB ' HD22 ' A' ' 4' ' ' LEU . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.459 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.538 HG22 ' CD1' ' A' ' 66' ' ' ILE . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.906 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.554 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.059 HG13 HD13 ' A' ' 52' ' ' LEU . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.882 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.567 HD22 HG12 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.408 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.833 0.349 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.809 ' HA ' HD21 ' A' ' 32' ' ' LEU . 39.8 p90 -68.86 180.0 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.793 HD22 ' CB ' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.779 HG11 ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.859 HD12 ' N ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.498 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.854 ' HB2' HG11 ' A' ' 22' ' ' VAL . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' HG13 ' A' ' 22' ' ' VAL . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 23' ' ' ALA . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.544 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.854 HG11 ' HB2' ' A' ' 11' ' ' PRO . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB2' HD11 ' A' ' 14' ' ' ILE . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.787 ' CE2' HD12 ' A' ' 101' ' ' LEU . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.743 HG12 HG12 ' A' ' 8' ' ' ILE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.662 HG23 HD21 ' A' ' 4' ' ' LEU . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.822 HG23 ' HG3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.009 HD22 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.822 ' HG3' HG23 ' A' ' 30' ' ' THR . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.646 HG13 HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.679 ' CD2' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.88 HD13 HG23 ' A' ' 120' ' ' VAL . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.631 HD13 ' CZ ' ' A' ' 65' ' ' PHE . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -76.2 -44.01 39.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.38 -33.9 75.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.42 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -60.46 -27.76 67.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.152 -179.672 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.406 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 74.1 m80 -157.86 130.68 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.386 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -81.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.549 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.42 -40.07 3.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.773 0.32 . . . . 0.0 111.316 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -52.04 122.04 7.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.136 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.82 85.53 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.425 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.631 ' CZ ' HD13 ' A' ' 56' ' ' LEU . 1.4 m-85 61.57 -82.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.655 0.264 . . . . 0.0 110.989 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.1 mt -152.26 -49.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 111.057 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.801 HG23 ' CD ' ' A' ' 70' ' ' PRO . 15.2 m -96.93 170.58 7.13 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.01 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.491 ' CD ' ' HB ' ' A' ' 67' ' ' VAL . 27.1 Cg_exo -64.36 -46.07 8.28 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.968 2.445 . . . . 0.0 114.37 -178.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.576 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 91.1 Cg_exo -42.62 -49.07 6.74 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.793 2.329 . . . . 0.0 113.627 -178.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.801 ' CD ' HG23 ' A' ' 67' ' ' VAL . 96.8 Cg_exo -40.35 -177.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.147 2.565 . . . . 0.0 113.557 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' A' ' 70' ' ' PRO . 87.6 Cg_exo -47.68 150.91 3.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.632 2.221 . . . . 0.0 112.736 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -155.65 166.62 32.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.873 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mttp 64.0 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.15 94.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.056 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -116.97 43.31 2.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.736 HG21 ' CB ' ' A' ' 100' ' ' ALA . 14.3 mt -107.33 -19.37 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.314 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.3 -101.49 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.921 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.426 ' O ' ' N ' ' A' ' 80' ' ' LYS . 4.8 mtm 58.18 -88.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.422 0.154 . . . . 0.0 110.743 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 p 44.98 -90.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.506 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 78' ' ' MET . 0.4 OUTLIER 59.01 179.77 0.08 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.949 0.404 . . . . 0.0 111.202 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.8 m -81.97 -167.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.097 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp 63.7 115.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.871 0.367 . . . . 0.0 111.058 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.9 t -135.42 74.66 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 93.25 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.605 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -176.81 126.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.851 0.358 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.45 -179.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.064 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 t0 75.36 -167.19 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 45.8 t -53.54 -68.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.079 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.16 -73.23 0.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.804 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.421 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t -178.84 133.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.421 HD23 ' HG2' ' A' ' 11' ' ' PRO . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.565 ' NH1' ' HB2' ' A' ' 99' ' ' ALA . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.565 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.736 ' CB ' HG21 ' A' ' 76' ' ' ILE . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.787 HD12 ' CE2' ' A' ' 24' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.859 ' N ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.779 ' CD2' HG11 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.785 HG21 ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.93 HG12 ' CD2' ' A' ' 124' ' ' LEU . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.4 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 3.0 m-70 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.424 ' O ' ' CE2' ' A' ' 65' ' ' PHE . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.67 HD22 HG23 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.471 ' CB ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.88 HG23 HD13 ' A' ' 52' ' ' LEU . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.609 ' CD2' HD11 ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.93 ' CD2' HG12 ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.851 0.357 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.816 ' CE1' HD22 ' A' ' 34' ' ' LEU . 2.9 t80 -93.55 -21.55 19.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.126 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.709 ' HB2' HD13 ' A' ' 32' ' ' LEU . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.702 HD22 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.806 HG21 HG13 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.553 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.581 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HE3' ' HB3' ' A' ' 20' ' ' ALA . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.869 ' O ' ' HB1' ' A' ' 20' ' ' ALA . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.431 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.438 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' HD2' HD12 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.86 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.806 HG13 HG21 ' A' ' 6' ' ' VAL . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.548 HG21 HD11 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' THR . 2.1 pm0 -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.726 HD22 ' O ' ' A' ' 2' ' ' PHE . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.816 HD22 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.418 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.86 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.607 HG21 ' HB2' ' A' ' 125' ' ' GLU . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.449 ' CE1' ' CD2' ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.956 HD13 HG13 ' A' ' 120' ' ' VAL . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.31 -44.29 96.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.36 -47.92 25.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -39.99 95.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.087 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.3 t60 63.26 170.7 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.738 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.98 114.0 26.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -173.3 -49.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -116.19 147.01 41.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.771 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.59 -51.77 1.08 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.544 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -80.85 -44.43 18.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.689 0.28 . . . . 0.0 111.027 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 mm 71.23 -61.41 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.439 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.636 HG23 ' HD2' ' A' ' 69' ' ' PRO . 31.0 m -59.66 137.7 89.81 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.98 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.614 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 53.8 Cg_endo -96.38 18.3 0.61 Allowed 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.98 2.454 . . . . 0.0 116.039 -178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.636 ' HD2' HG23 ' A' ' 67' ' ' VAL . 45.8 Cg_exo -54.01 -168.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.416 1.411 . . . . 0.0 111.874 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.498 ' HD2' ' CB ' ' A' ' 69' ' ' PRO . 91.2 Cg_exo -42.57 -43.0 8.47 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.55 2.167 . . . . 0.0 113.84 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 41.9 Cg_exo -57.6 91.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.228 1.952 . . . . 0.0 112.115 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.422 ' O ' ' CG ' ' A' ' 73' ' ' LYS . 17.4 pt-20 -167.19 -38.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.263 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER 50.09 -177.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.51 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.44 43.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.819 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 tp 62.97 132.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.028 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.575 ' H ' HD12 ' A' ' 76' ' ' ILE . 3.6 mp -90.11 95.41 5.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.07 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.92 -171.46 9.56 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.327 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.68 19.5 1.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.153 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.431 HG22 ' H ' ' A' ' 80' ' ' LYS . 0.2 OUTLIER 50.78 -166.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.431 ' H ' HG22 ' A' ' 79' ' ' THR . 5.7 mttm -143.05 138.81 30.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.885 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 81' ' ' VAL . 27.0 m -79.59 110.65 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.26 107.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -47.84 -80.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.42 -179.871 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.532 ' H ' HG23 ' A' ' 83' ' ' VAL . . . 79.05 -58.73 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.805 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -80.64 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.572 0.225 . . . . 0.0 111.174 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.27 130.04 38.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -137.82 -50.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.3 t 62.18 -80.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.997 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.5 p -179.98 156.09 0.63 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -97.94 -31.25 12.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.581 ' N ' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 105' ' ' LEU . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.421 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.956 HG13 HD13 ' A' ' 52' ' ' LEU . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.502 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.626 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.685 HD13 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.607 ' HB2' HG21 ' A' ' 42' ' ' VAL . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 123' ' ' PHE . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.567 ' HE1' HD13 ' A' ' 34' ' ' LEU . 22.7 t80 58.11 -110.3 0.51 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.742 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.746 HD11 ' CG2' ' A' ' 28' ' ' THR . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 5' ' ' THR . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.539 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.45 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.444 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.409 ' N ' ' CG2' ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.517 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.885 HG23 ' HB ' ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.589 ' O ' HG22 ' A' ' 27' ' ' THR . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.746 ' CG2' HD11 ' A' ' 4' ' ' LEU . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 3' ' ' ASP . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' HE1' ' A' ' 2' ' ' PHE . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.412 HH12 HD11 ' A' ' 124' ' ' LEU . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.885 ' HB ' HG23 ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.075 HD13 HG13 ' A' ' 120' ' ' VAL . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' A' ' 56' ' ' LEU . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t -56.5 -31.48 64.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.18 -41.2 92.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -46.37 8.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.897 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.34 113.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.361 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.856 ' O ' HD12 ' A' ' 76' ' ' ILE . 0.2 OUTLIER -98.51 -174.77 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.678 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -179.27 -72.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.06 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -116.09 138.36 51.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.026 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' HA2' ' CG2' ' A' ' 67' ' ' VAL . . . 141.33 -126.4 3.04 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.691 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 73.29 -62.24 0.47 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.668 0.27 . . . . 0.0 111.264 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 6.6 tt -92.1 41.78 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.85 0.357 . . . . 0.0 111.398 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.469 HG12 ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -132.32 138.5 32.37 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.189 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.491 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 2.7 Cg_endo -43.23 -50.61 6.4 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.105 2.537 . . . . 0.0 113.088 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 68' ' ' PRO . 57.5 Cg_exo -35.66 151.87 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.044 2.496 . . . . 0.0 113.422 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 69' ' ' PRO . 42.0 Cg_exo -56.84 178.72 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.734 2.289 . . . . 0.0 112.575 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.46 -59.97 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.821 2.348 . . . . 0.0 112.467 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.2 72.51 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.22 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -132.47 56.45 1.83 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.839 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' HD22 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -172.94 176.66 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.814 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.484 HD22 ' O ' ' A' ' 74' ' ' SER . 0.2 OUTLIER -161.85 30.37 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.091 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.856 HD12 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 46.25 -172.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.477 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.657 ' N ' HG23 ' A' ' 76' ' ' ILE . . . 124.23 -104.27 0.81 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.589 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 34.4 tpp 68.72 -67.33 0.21 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.819 0.342 . . . . 0.0 110.943 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.9 p -124.96 105.67 9.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.872 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.12 141.51 58.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.621 HG22 ' O ' ' A' ' 81' ' ' VAL . 14.7 p -140.48 35.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.98 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.44 129.13 55.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.7 t 63.89 67.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.05 -120.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.456 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -77.27 0.41 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.797 0.332 . . . . 0.0 110.869 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -146.64 171.49 15.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.929 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 t0 59.4 161.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.47 89.98 4.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.9 p -59.14 103.83 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m -108.91 -31.83 7.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.427 ' NZ ' HG11 ' A' ' 81' ' ' VAL . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.427 ' CD ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.804 ' HB2' HD12 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.956 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.641 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.629 ' HG2' HD13 ' A' ' 108' ' ' ILE . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.956 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.939 HG22 ' O ' ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 0.1 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.476 ' HE2' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.552 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.075 HG13 HD13 ' A' ' 52' ' ' LEU . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.417 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.747 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.717 HD22 HG13 ' A' ' 109' ' ' VAL . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.732 0.301 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.563 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.818 HD22 ' CG2' ' A' ' 109' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.913 HG21 HG13 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.702 HD12 ' HB2' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' THR . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CB ' HG11 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.471 ' CE1' HG21 ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG11 ' CB ' ' A' ' 11' ' ' PRO . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.97 ' CE2' HD22 ' A' ' 101' ' ' LEU . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.913 HG13 HG21 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.592 HG23 ' HG ' ' A' ' 4' ' ' LEU . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 5.2 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 8.9 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 25' ' ' LYS . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.432 HG23 ' HA ' ' A' ' 127' ' ' GLU . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' CD ' ' HB3' ' A' ' 47' ' ' SER . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.441 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.713 ' CD2' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.047 HD13 HG13 ' A' ' 120' ' ' VAL . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HB2' HD13 ' A' ' 50' ' ' LEU . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 52' ' ' LEU . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.731 0.3 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HB3' HG22 ' A' ' 8' ' ' ILE . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.97 HD22 ' CE2' ' A' ' 24' ' ' TYR . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.702 ' HB2' HD12 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.587 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HA ' HG22 ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.85 HG23 ' HE1' ' A' ' 114' ' ' MET . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 1.051 HG12 HD23 ' A' ' 124' ' ' LEU . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.483 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.85 ' HE1' HG23 ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.872 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.047 HG13 HD13 ' A' ' 52' ' ' LEU . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.72 ' HA ' HD22 ' A' ' 115' ' ' LEU . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 1.051 HD23 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.551 ' H ' HD12 ' A' ' 124' ' ' LEU . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.414 ' O ' HG21 ' A' ' 42' ' ' VAL . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 42' ' ' VAL . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.498 ' HE1' HD22 ' A' ' 34' ' ' LEU . 18.3 t80 . . . . . 0 CA--C 1.531 0.224 0 CA-C-O 120.68 0.276 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.613 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.93 HD22 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.819 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.909 HD12 ' HB2' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.671 ' O ' HD12 ' A' ' 14' ' ' ILE . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 12' ' ' GLU . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.645 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.652 HG13 ' N ' ' A' ' 12' ' ' GLU . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' H ' HD13 ' A' ' 14' ' ' ILE . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.512 ' CD2' HD12 ' A' ' 101' ' ' LEU . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.869 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.819 HG13 HG21 ' A' ' 6' ' ' VAL . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 40' ' ' PHE . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.819 HG23 HG12 ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 39' ' ' GLN . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.43 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.523 ' O ' HD12 ' A' ' 32' ' ' LEU . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.613 HD13 ' CB ' ' A' ' 3' ' ' ASP . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 2' ' ' PHE . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.638 ' NH2' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 29' ' ' GLN . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 48' ' ' ASP . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.415 ' HG ' ' HB2' ' A' ' 54' ' ' GLU . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' OH ' ' A' ' 104' ' ' TYR . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.786 0.327 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 97' ' ' ARG . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 49' ' ' PHE . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.909 ' HB2' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 56' ' ' LEU . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.598 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.622 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.838 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.93 ' CG2' HD22 ' A' ' 4' ' ' LEU . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 3.3 t-20 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.413 ' O ' ' HG3' ' A' ' 114' ' ' MET . 15.5 m170 -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.752 ' SD ' HD13 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.838 HD11 ' O ' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.559 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.475 ' O ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' CD1' HG12 ' A' ' 109' ' ' VAL . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.452 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.579 ' HB3' HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.796 0.332 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.707 ' H ' HD13 ' A' ' 32' ' ' LEU . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.755 HD12 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' THR . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.704 ' CG2' HG13 ' A' ' 26' ' ' VAL . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.686 HG22 ' HG3' ' A' ' 98' ' ' ARG . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.578 HD13 ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.467 ' N ' HG23 ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.578 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.704 HG13 ' CG2' ' A' ' 6' ' ' VAL . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.627 HG23 ' CD1' ' A' ' 4' ' ' LEU . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.707 HD13 ' H ' ' A' ' 3' ' ' ASP . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.696 HH12 HD12 ' A' ' 124' ' ' LEU . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.595 ' HB1' ' HD3' ' A' ' 25' ' ' LYS . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.408 ' HG3' ' HB2' ' A' ' 21' ' ' TYR . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.862 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.71 ' CD1' HD11 ' A' ' 108' ' ' ILE . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.957 0.408 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 96' ' ' LYS . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 94' ' ' LEU . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.686 ' HG3' HG22 ' A' ' 8' ' ' ILE . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.542 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.573 ' CA ' HD13 ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.676 ' O ' HG13 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.691 ' HA ' HG22 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.605 ' HD2' ' HE1' ' A' ' 114' ' ' MET . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 56' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.755 HG21 HD12 ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.529 ' O ' HD13 ' A' ' 115' ' ' LEU . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.605 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.966 HD23 ' HA ' ' A' ' 121' ' ' ARG . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.862 HG13 HD13 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.966 ' HA ' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.696 HD12 HH12 ' A' ' 36' ' ' ARG . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.628 ' HA ' HD22 ' A' ' 32' ' ' LEU . 37.7 p90 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.836 0.351 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.567 ' H ' HD13 ' A' ' 32' ' ' LEU . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.896 HD12 ' CG2' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.587 HG21 HG13 ' A' ' 26' ' ' VAL . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.57 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.502 HG22 ' HG2' ' A' ' 98' ' ' ARG . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.657 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.588 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.614 HD12 ' O ' ' A' ' 12' ' ' GLU . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.588 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.657 HG13 ' N ' ' A' ' 12' ' ' GLU . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.44 ' N ' ' CG1' ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.649 ' CE2' HD12 ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.587 HG13 HG21 ' A' ' 6' ' ' VAL . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.525 HG23 HD11 ' A' ' 4' ' ' LEU . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.628 HD22 ' HA ' ' A' ' 2' ' ' PHE . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.569 ' O ' HD12 ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.935 ' NH1' HD11 ' A' ' 124' ' ' LEU . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.45 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 29' ' ' GLN . 1.1 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.433 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.614 HG23 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.614 ' HD2' HG23 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' HD12 ' A' ' 50' ' ' LEU . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.436 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.47 ' HE2' HG21 ' A' ' 26' ' ' VAL . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.504 HD23 ' OE2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.86 HD21 ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.504 ' OE2' HD23 ' A' ' 50' ' ' LEU . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.687 HD23 ' NH1' ' A' ' 107' ' ' ARG . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.862 0.363 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 94' ' ' LEU . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.502 ' HG2' HG22 ' A' ' 8' ' ' ILE . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.649 HD12 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.499 ' N ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.509 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.2 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.687 ' NH1' HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.72 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.896 ' CG2' HD12 ' A' ' 4' ' ' LEU . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 0.8 OUTLIER -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.402 ' HA ' HD23 ' A' ' 115' ' ' LEU . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.619 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 115' ' ' LEU . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.462 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.77 HG23 HD13 ' A' ' 52' ' ' LEU . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.86 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HG2' HG12 ' A' ' 42' ' ' VAL . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.935 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 1.8 t80 . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 119.969 -0.063 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.859 HD22 HG21 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.863 HG22 ' HA ' ' A' ' 28' ' ' THR . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.583 HD12 ' N ' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.447 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.639 HG21 ' CE1' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.639 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 12' ' ' GLU . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.932 ' CE2' HD22 ' A' ' 101' ' ' LEU . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.623 HG13 HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.863 ' HA ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.734 HG21 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' CD2' ' CB ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.935 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.734 ' HB2' HG21 ' A' ' 30' ' ' THR . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' GLN . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.885 ' CD1' HD11 ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 54' ' ' GLU . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.023 HD13 HG13 ' A' ' 120' ' ' VAL . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 50' ' ' LEU . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.719 HD12 ' OH ' ' A' ' 104' ' ' TYR . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.825 0.345 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.932 HD22 ' CE2' ' A' ' 24' ' ' TYR . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.583 ' N ' HD12 ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.719 ' OH ' HD12 ' A' ' 56' ' ' LEU . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.718 ' O ' HG22 ' A' ' 109' ' ' VAL . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.638 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.956 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.859 HG21 HD22 ' A' ' 4' ' ' LEU . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 10.3 t-80 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.425 ' HD2' ' CD2' ' A' ' 111' ' ' HIS . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.956 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.624 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.023 HG13 HD13 ' A' ' 52' ' ' LEU . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.644 ' HA ' HD22 ' A' ' 115' ' ' LEU . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.542 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.757 HD13 HG12 ' A' ' 109' ' ' VAL . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.468 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.809 0.338 . . . . 0.0 110.926 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.62 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.695 HG22 ' HB2' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.85 ' HB2' HG11 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' HG13 ' A' ' 22' ' ' VAL . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.521 ' C ' HD13 ' A' ' 14' ' ' ILE . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.87 HD11 ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.85 HG11 ' HB2' ' A' ' 11' ' ' PRO . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.87 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.537 HG23 ' HB2' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.62 HD13 ' CB ' ' A' ' 3' ' ' ASP . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.468 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB2' HG23 ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' HB1' ' A' ' 23' ' ' ALA . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.063 HD13 HG13 ' A' ' 120' ' ' VAL . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.414 ' HD2' HD13 ' A' ' 50' ' ' LEU . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.459 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.743 0.306 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.695 ' HB2' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.6 ' CA ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.561 HD23 HG11 ' A' ' 6' ' ' VAL . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.613 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.804 HG23 ' HG ' ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 4' ' ' LEU . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.472 ' O ' ' HG2' ' A' ' 114' ' ' MET . 0.4 OUTLIER -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.878 ' O ' HD22 ' A' ' 115' ' ' LEU . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' ' O ' ' A' ' 111' ' ' HIS . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.878 HD22 ' O ' ' A' ' 112' ' ' PRO . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 118' ' ' PRO . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.063 HG13 HD13 ' A' ' 52' ' ' LEU . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.666 ' HD2' HD23 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.6 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 125' ' ' GLU . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.618 ' HB2' HD12 ' A' ' 124' ' ' LEU . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.669 ' O ' HD23 ' A' ' 32' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.861 0.362 . . . . 0.0 111.265 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB3' HD23 ' A' ' 32' ' ' LEU . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.742 HD22 ' CB ' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.797 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.719 HG22 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.414 ' O ' ' O ' ' A' ' 9' ' ' THR . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.839 ' HB2' HG11 ' A' ' 22' ' ' VAL . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.637 ' C ' HD12 ' A' ' 14' ' ' ILE . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 13' ' ' LYS . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.839 HG11 ' HB2' ' A' ' 11' ' ' PRO . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.522 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.598 ' NZ ' ' HB1' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.797 HG13 HG21 ' A' ' 6' ' ' VAL . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.722 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.602 HG22 ' HG3' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.491 HD23 HD12 ' A' ' 32' ' ' LEU . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.602 ' HG3' HG22 ' A' ' 30' ' ' THR . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.598 ' HB1' ' NZ ' ' A' ' 25' ' ' LYS . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.429 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.648 ' CZ ' HG21 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.676 HD21 ' OE2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.059 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.676 ' OE2' HD21 ' A' ' 50' ' ' LEU . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 52' ' ' LEU . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t . . . . . 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.75 0.309 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HG2' ' A' ' 11' ' ' PRO . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.719 ' HG2' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.522 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.527 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.644 ' CE1' HD11 ' A' ' 108' ' ' ILE . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.69 HD22 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.678 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.906 ' HA ' ' HE3' ' A' ' 114' ' ' MET . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.742 ' CB ' HD22 ' A' ' 4' ' ' LEU . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.459 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.906 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.554 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.059 HG13 HD13 ' A' ' 52' ' ' LEU . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.882 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.567 HD22 HG12 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.408 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.809 ' HA ' HD21 ' A' ' 32' ' ' LEU . 39.8 p90 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.821 0.343 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.793 HD22 ' CB ' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.779 HG11 ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.859 HD12 ' N ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.498 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.854 ' HB2' HG11 ' A' ' 22' ' ' VAL . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' HG13 ' A' ' 22' ' ' VAL . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 23' ' ' ALA . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.544 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.854 HG11 ' HB2' ' A' ' 11' ' ' PRO . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB2' HD11 ' A' ' 14' ' ' ILE . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.787 ' CE2' HD12 ' A' ' 101' ' ' LEU . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.743 HG12 HG12 ' A' ' 8' ' ' ILE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.662 HG23 HD21 ' A' ' 4' ' ' LEU . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.822 HG23 ' HG3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.009 HD22 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.822 ' HG3' HG23 ' A' ' 30' ' ' THR . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.646 HG13 HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.679 ' CD2' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.88 HD13 HG23 ' A' ' 120' ' ' VAL . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.421 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.845 0.355 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.421 HD23 ' HG2' ' A' ' 11' ' ' PRO . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.565 ' NH1' ' HB2' ' A' ' 99' ' ' ALA . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . 0.565 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.787 HD12 ' CE2' ' A' ' 24' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.859 ' N ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.779 ' CD2' HG11 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.785 HG21 ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.93 HG12 ' CD2' ' A' ' 124' ' ' LEU . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.4 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 50.0 m170 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.67 HD22 HG23 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.471 ' CB ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.88 HG23 HD13 ' A' ' 52' ' ' LEU . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.609 ' CD2' HD11 ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.93 ' CD2' HG12 ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.816 ' CE1' HD22 ' A' ' 34' ' ' LEU . 2.9 t80 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.656 0.265 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.709 ' HB2' HD13 ' A' ' 32' ' ' LEU . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.702 HD22 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.806 HG21 HG13 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.553 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.581 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HE3' ' HB3' ' A' ' 20' ' ' ALA . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.869 ' O ' ' HB1' ' A' ' 20' ' ' ALA . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.431 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.438 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.469 ' HD2' HD12 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.86 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.806 HG13 HG21 ' A' ' 6' ' ' VAL . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.548 HG21 HD11 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.726 HD22 ' O ' ' A' ' 2' ' ' PHE . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.816 HD22 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.418 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.86 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.607 HG21 ' HB2' ' A' ' 125' ' ' GLU . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.449 ' CE1' ' CD2' ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.956 HD13 HG13 ' A' ' 120' ' ' VAL . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.847 0.356 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.581 ' N ' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 105' ' ' LEU . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.421 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.956 HG13 HD13 ' A' ' 52' ' ' LEU . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.502 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.626 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.685 HD13 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.607 ' HB2' HG21 ' A' ' 42' ' ' VAL . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 123' ' ' PHE . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.567 ' HE1' HD13 ' A' ' 34' ' ' LEU . 22.7 t80 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 110.742 -0.095 . . . . 0.0 110.742 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.746 HD11 ' CG2' ' A' ' 28' ' ' THR . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 5' ' ' THR . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.539 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.45 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.444 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.409 ' N ' ' CG2' ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.517 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.885 HG23 ' HB ' ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.589 ' O ' HG22 ' A' ' 27' ' ' THR . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.746 ' CG2' HD11 ' A' ' 4' ' ' LEU . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 3' ' ' ASP . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' HE1' ' A' ' 2' ' ' PHE . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.412 HH12 HD11 ' A' ' 124' ' ' LEU . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.885 ' HB ' HG23 ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.075 HD13 HG13 ' A' ' 120' ' ' VAL . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' A' ' 56' ' ' LEU . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.843 0.354 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.427 ' CD ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.804 ' HB2' HD12 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.956 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.641 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.629 ' HG2' HD13 ' A' ' 108' ' ' ILE . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.956 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.939 HG22 ' O ' ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 0.0 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.476 ' HE2' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.552 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.075 HG13 HD13 ' A' ' 52' ' ' LEU . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.417 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . 0.747 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.717 HD22 HG13 ' A' ' 109' ' ' VAL . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.746 0.308 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -157.65 24.81 0.28 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.563 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER 53.71 22.73 3.28 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.248 -179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.818 HD22 ' CG2' ' A' ' 109' ' ' VAL . 7.5 tt -120.16 116.42 25.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.103 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 m -128.51 96.97 4.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.825 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.913 HG21 HG13 ' A' ' 26' ' ' VAL . 0.2 OUTLIER -106.09 146.86 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.114 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -133.61 112.74 1.12 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.495 178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.702 HD12 ' HB2' ' A' ' 102' ' ' GLU . 14.7 mt -80.57 127.27 39.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.74 123.94 20.47 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' THR . 2.7 p30 49.17 147.46 0.02 OUTLIER Pre-proline 0 N--CA 1.455 -0.207 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 177.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CB ' HG11 ' A' ' 22' ' ' VAL . 13.4 Cg_endo -107.39 98.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.382 1 C-N-CA 125.698 4.265 . . . . 0.0 111.747 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -84.83 151.81 24.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.746 0.308 . . . . 0.0 111.243 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.97 130.81 35.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.346 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.617 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -97.85 -65.67 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.967 -179.054 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.58 172.92 17.83 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.544 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -174.69 129.7 0.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.34 . . . . 0.0 111.006 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.41 -35.31 2.3 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.42 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.5 ttt -156.9 -67.79 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -123.25 94.11 4.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.57 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.31 22.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.455 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.471 ' CE1' HG21 ' A' ' 14' ' ' ILE . 10.0 p90 -120.27 159.85 24.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.706 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG11 ' CB ' ' A' ' 11' ' ' PRO . 50.3 t -99.59 149.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.492 0.663 . . . . 0.0 110.734 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -100.91 -175.89 3.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.538 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.97 ' CE2' HD22 ' A' ' 101' ' ' LEU . 7.3 m-85 -134.5 113.63 12.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 11.6 tppt? -81.36 90.38 6.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.066 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.913 HG13 HG21 ' A' ' 6' ' ' VAL . 69.5 t -99.87 90.84 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.423 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 70.0 m -85.88 74.24 10.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.21 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.592 HG23 ' HG ' ' A' ' 4' ' ' LEU . 58.9 m -79.8 147.01 31.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.441 ' HA ' ' CB ' ' A' ' 39' ' ' GLN . 5.2 pt20 -142.22 119.04 11.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.958 0.409 . . . . 0.0 111.4 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 36' ' ' ARG . 1.5 t -143.82 100.23 3.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.547 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m -69.99 -15.62 63.06 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.199 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' ' 3' ' ' ASP . 5.1 mp -49.53 159.9 0.64 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.186 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -83.21 48.32 2.67 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.748 2.298 . . . . 0.0 112.355 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 mt -112.63 -60.45 1.87 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.038 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -165.25 -166.8 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.001 0.429 . . . . 0.0 111.39 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.45 ' NH1' ' CE1' ' A' ' 40' ' ' PHE . 1.5 mmt85 67.99 -72.23 0.1 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.072 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.17 119.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.884 0.373 . . . . 0.0 111.121 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 39' ' ' GLN . 5.2 mtpt 68.4 9.24 7.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.479 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' O ' ' A' ' 38' ' ' LYS . 8.9 pt20 47.17 176.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.11 0.481 . . . . 0.0 112.041 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.45 ' CE1' ' NH1' ' A' ' 36' ' ' ARG . 4.7 p90 170.8 -169.83 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.394 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 25' ' ' LYS . . . -128.02 137.43 52.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.432 HG23 ' HA ' ' A' ' 127' ' ' GLU . 0.2 OUTLIER -117.09 147.35 20.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.704 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -113.35 122.67 48.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.388 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.6 159.18 44.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.694 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' CD ' ' HB3' ' A' ' 47' ' ' SER . 0.4 OUTLIER -82.71 162.8 21.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.963 0.411 . . . . 0.0 111.152 -179.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.441 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . 13.7 p90 -68.01 -39.48 83.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.021 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.429 ' N ' ' CD1' ' A' ' 46' ' ' PHE . 1.0 OUTLIER -51.0 -30.88 16.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.024 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.421 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 22.6 m-20 -82.11 -51.01 8.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.875 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.713 ' CD2' HD21 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -59.57 -31.08 69.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.089 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -55.83 -33.59 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.746 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.6 -28.01 9.76 Favored Glycine 0 CA--C 1.518 0.257 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.658 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.047 HD13 HG13 ' A' ' 120' ' ' VAL . 1.7 mt -83.29 -57.18 3.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.68 0.752 . . . . 0.0 109.92 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 68' ' ' PRO . 69.2 t80 -52.93 -36.79 60.16 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.341 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HB2' HD13 ' A' ' 50' ' ' LEU . 5.4 tt0 -76.57 -52.99 8.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.925 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -60.38 -37.22 80.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.435 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 52' ' ' LEU . 2.3 mm? -46.72 -45.56 19.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.233 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.09 -31.96 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.691 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.93 -25.43 11.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.554 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.47 -24.02 11.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.601 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.05 -176.11 1.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.869 0.366 . . . . 0.0 111.107 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.0 p -116.82 -33.49 4.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.326 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.53 -66.54 0.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -84.78 153.13 23.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.037 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.39 55.51 2.19 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.666 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 55.47 87.5 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.881 0.372 . . . . 0.0 110.942 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.464 ' O ' HG13 ' A' ' 66' ' ' ILE . 5.8 tp -98.4 35.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.622 ' O ' HG13 ' A' ' 67' ' ' VAL . 7.6 p -132.31 98.46 16.92 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.335 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 41.1 Cg_exo -55.94 -43.57 55.63 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.454 2.103 . . . . 0.0 112.128 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 72.7 Cg_exo -51.01 -167.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.816 2.344 . . . . 0.0 112.231 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.509 ' CD ' ' CB ' ' A' ' 69' ' ' PRO . 80.3 Cg_exo -46.01 173.3 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.451 2.101 . . . . 0.0 112.712 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.415 ' HG3' ' CD ' ' A' ' 107' ' ' ARG . 82.2 Cg_exo -43.1 -38.92 7.83 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.754 2.302 . . . . 0.0 112.552 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -138.63 179.9 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.83 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -64.35 103.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.908 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.75 41.61 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.938 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 75' ' ' LEU . 3.1 mt 68.88 -65.43 0.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.024 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.522 HD12 ' CB ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -50.4 -41.29 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.256 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' N ' HG23 ' A' ' 76' ' ' ILE . . . -55.36 -94.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.601 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.468 ' HE1' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -115.81 129.58 56.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 110.98 179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 70.2 m -163.99 -60.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.863 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.48 38.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.849 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.481 HG23 ' N ' ' A' ' 82' ' ' LYS . 23.6 m -57.72 -45.96 86.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.245 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.481 ' N ' HG23 ' A' ' 81' ' ' VAL . 2.3 mtpp 67.38 -69.41 0.13 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.122 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.4 m -61.6 -179.25 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.302 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.06 -78.66 0.51 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.463 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -170.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.951 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -72.07 150.06 44.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -140.87 -47.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.853 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.5 p 62.55 122.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.016 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.9 m -103.18 -31.31 10.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 19.3 p -150.49 172.14 15.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.87 90.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -62.45 -28.76 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.994 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -55.65 -36.98 67.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mt -57.81 -30.12 65.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.059 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -78.01 -33.21 51.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.101 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -40.0 75.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -31.6 70.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.079 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HB3' HG22 ' A' ' 8' ' ' ILE . 77.3 mmt-85 -63.73 -50.86 67.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.796 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -51.15 -56.07 14.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.337 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.522 ' CB ' HD12 ' A' ' 76' ' ' ILE . . . -58.23 -30.55 66.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.408 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.97 HD22 ' CE2' ' A' ' 24' ' ' TYR . 2.6 tp -58.96 -37.82 77.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.288 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.702 ' HB2' HD12 ' A' ' 8' ' ' ILE . 3.9 tt0 -72.53 -37.34 68.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.204 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.445 ' HB2' ' HG3' ' A' ' 70' ' ' PRO . 4.5 mtp-105 -58.08 -48.44 80.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.0 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 101' ' ' LEU . 0.1 OUTLIER -71.24 -33.55 69.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.113 178.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.587 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.9 OUTLIER -63.71 -41.88 98.02 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.827 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HA ' HG22 ' A' ' 109' ' ' VAL . 40.9 mt-30 -55.03 -40.92 70.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.415 ' CD ' ' HG3' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -63.68 -49.56 72.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.649 0.261 . . . . 0.0 111.254 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.85 HG23 ' HE1' ' A' ' 114' ' ' MET . 0.2 OUTLIER -63.84 -47.41 90.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.172 179.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 1.051 HG12 HD23 ' A' ' 124' ' ' LEU . 26.7 m -65.74 -30.4 49.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.103 0.478 . . . . 0.0 109.736 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' CB ' ' O ' ' A' ' 106' ' ' GLN . 6.4 t-20 -61.71 -57.88 10.23 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.694 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.484 ' O ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -102.98 123.42 42.13 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.034 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.483 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 35.0 Cg_endo -64.37 -28.33 63.05 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.354 2.036 . . . . 0.0 112.063 179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.9 m -79.17 -33.36 44.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.85 ' HE1' HG23 ' A' ' 108' ' ' ILE . 2.6 tmm? -55.78 -56.68 17.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.014 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.72 HD22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -48.51 -52.3 23.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.746 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 66.68 -68.49 0.14 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.876 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.872 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -56.93 127.56 75.35 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.193 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.39 -28.06 33.77 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.569 2.179 . . . . 0.0 112.303 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' A' ' 123' ' ' PHE . 3.5 m-20 -75.48 -43.99 46.35 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.743 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.047 HG13 HD13 ' A' ' 52' ' ' LEU . 16.7 t -59.5 -43.79 91.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.72 ' HA ' HD22 ' A' ' 115' ' ' LEU . 5.1 ttm-85 -56.89 -30.07 63.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.874 178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -112.39 12.88 20.2 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.14 -36.73 27.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.849 0.357 . . . . 0.0 110.952 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 1.051 HD23 HG12 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -54.67 -22.55 14.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.339 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.551 ' H ' HD12 ' A' ' 124' ' ' LEU . 0.6 OUTLIER -115.93 1.13 13.27 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.642 0.258 . . . . 0.0 111.51 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.414 ' O ' HG21 ' A' ' 42' ' ' VAL . 21.8 tttp -53.53 119.01 4.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.861 0.362 . . . . 0.0 111.222 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 42' ' ' VAL . 3.6 mt-10 -89.87 -76.04 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.916 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.82 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 70.9 mm-40 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.498 ' HE1' HD22 ' A' ' 34' ' ' LEU . 18.3 t80 -92.2 8.06 39.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.192 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.613 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.1 OUTLIER 63.11 16.78 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.354 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.93 HD22 ' CG2' ' A' ' 109' ' ' VAL . 9.5 tt -98.43 108.57 21.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.794 0.331 . . . . 0.0 110.837 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.2 m -118.23 121.8 41.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.99 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.819 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -129.48 140.47 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.539 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -121.46 113.46 2.31 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.543 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.909 HD12 ' HB2' ' A' ' 102' ' ' GLU . 4.7 mt -81.89 116.99 27.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.069 0.461 . . . . 0.0 110.709 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.65 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 4.6 m -155.62 134.34 11.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.967 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 22.6 t70 120.81 -28.62 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 O-C-N 123.616 0.573 . . . . 0.0 111.885 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.681 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 42.5 Cg_exo -41.05 107.07 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.585 2.19 . . . . 0.0 113.52 -178.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.671 ' O ' HD12 ' A' ' 14' ' ' ILE . 7.3 pt-20 -136.87 175.19 9.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.851 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -77.95 99.93 6.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.054 0.454 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 12' ' ' GLU . 3.0 mp -92.66 -88.54 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.691 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.645 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 35.26 -112.24 0.1 OUTLIER Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.447 -0.406 . . . . 0.0 113.609 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -139.38 -63.6 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.386 . . . . 0.0 110.912 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.59 -93.82 0.13 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.454 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 10.7 mmt -67.92 -76.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.744 0.307 . . . . 0.0 110.706 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -79.04 73.16 5.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.928 0.394 . . . . 0.0 110.411 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -107.24 161.22 14.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.43 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -109.42 175.61 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.467 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.652 HG13 ' N ' ' A' ' 12' ' ' GLU . 97.2 t -119.74 146.56 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.586 0.707 . . . . 0.0 110.863 178.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' H ' HD13 ' A' ' 14' ' ' ILE . . . -97.86 117.05 31.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.099 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.512 ' CD2' HD12 ' A' ' 101' ' ' LEU . 16.6 m-85 -88.98 100.09 12.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.746 0.307 . . . . 0.0 111.128 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.869 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.96 89.66 4.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.509 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.819 HG13 HG21 ' A' ' 6' ' ' VAL . 98.0 t -93.05 98.9 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.184 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 40' ' ' PHE . 97.6 m -94.79 74.91 3.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.689 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.819 HG23 HG12 ' A' ' 6' ' ' VAL . 2.0 m -73.92 147.64 42.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.701 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 39' ' ' GLN . 0.6 OUTLIER -144.45 110.41 5.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.715 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.43 ' CG2' ' HG3' ' A' ' 36' ' ' ARG . 0.7 OUTLIER -127.26 100.29 6.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.465 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.523 ' O ' HD12 ' A' ' 32' ' ' LEU . 1.5 t -79.17 60.28 2.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.732 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.613 HD13 ' CB ' ' A' ' 3' ' ' ASP . 4.9 mp -128.51 156.49 77.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.709 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.48 56.82 5.24 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.528 2.152 . . . . 0.0 112.214 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 2' ' ' PHE . 4.4 mp -132.15 -68.89 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.221 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.6 -177.53 6.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.096 0.474 . . . . 0.0 111.589 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.638 ' NH2' HG21 ' A' ' 28' ' ' THR . 0.1 OUTLIER 66.23 -68.71 0.13 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.775 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 m 67.58 120.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.809 0.338 . . . . 0.0 110.362 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 71.26 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.808 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 29' ' ' GLN . 2.0 pt20 170.31 151.72 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.739 0.304 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -141.35 -163.3 1.53 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.397 0.617 . . . . 0.0 111.573 179.634 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -152.8 139.91 19.3 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.826 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.4 t -137.08 129.56 43.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.906 0.384 . . . . 0.0 111.283 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -119.49 119.98 35.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.963 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -131.09 158.85 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.415 ' HG2' ' HB2' ' A' ' 48' ' ' ASP . 11.6 ptp180 -77.24 156.53 31.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.266 179.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -54.01 -29.84 45.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.876 0.369 . . . . 0.0 111.051 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 t -69.22 -30.91 69.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.426 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' CZ ' ' A' ' 123' ' ' PHE . 7.9 t0 -75.66 -51.56 12.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.333 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 101' ' ' LEU . 10.0 t80 -61.13 -26.78 67.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.083 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.415 ' HG ' ' HB2' ' A' ' 54' ' ' GLU . 58.0 tp -54.69 -32.86 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.801 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.54 -36.03 17.12 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.759 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 123' ' ' PHE . 4.1 mt -83.42 -55.78 4.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.656 0.741 . . . . 0.0 110.159 179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -53.13 -42.11 65.72 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.14 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 8.3 tt0 -76.3 -41.37 48.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.077 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -49.17 74.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.224 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' OH ' ' A' ' 104' ' ' TYR . 3.1 mm? -64.62 -47.96 76.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.978 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 t -58.17 -38.15 76.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.015 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.96 -44.2 66.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.79 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mmpm? -61.86 -25.73 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.084 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 65.04 -76.65 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.6 m -137.41 172.66 12.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.907 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -174.31 136.83 0.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.948 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -100.42 153.13 19.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.847 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 123.93 12.17 4.55 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.867 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.656 ' C ' HD12 ' A' ' 66' ' ' ILE . 2.6 m-85 -108.53 63.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.797 0.332 . . . . 0.0 110.557 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.656 HD12 ' C ' ' A' ' 65' ' ' PHE . 3.6 mp 69.99 -65.61 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.852 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.825 HG12 ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -99.76 146.26 31.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.58 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.825 ' HD2' HG12 ' A' ' 67' ' ' VAL . 52.3 Cg_exo -52.07 -45.31 39.78 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.552 2.168 . . . . 0.0 112.783 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 68' ' ' PRO . 73.7 Cg_exo -50.39 145.23 21.97 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.398 2.066 . . . . 0.0 112.338 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.18 172.39 0.3 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.554 2.169 . . . . 0.0 112.442 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.28 -48.37 22.4 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.712 2.275 . . . . 0.0 112.274 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -178.02 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.981 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.9 15.7 1.91 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.325 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.445 ' OG ' ' N ' ' A' ' 75' ' ' LEU . 5.3 p 67.56 -64.94 0.25 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.297 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.445 ' N ' ' OG ' ' A' ' 74' ' ' SER . 0.9 OUTLIER 59.84 39.61 20.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 0.0 110.824 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.608 HG23 ' O ' ' A' ' 76' ' ' ILE . 8.6 tp -151.12 55.14 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.035 0.445 . . . . 0.0 111.101 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.88 36.79 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.649 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 18.9 mmt -133.1 94.88 3.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 110.867 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.81 -165.91 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -57.51 163.15 2.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.964 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.21 -46.39 88.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.406 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.719 ' O ' HG22 ' A' ' 83' ' ' VAL . 0.1 OUTLIER -171.07 -144.45 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.898 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.719 HG22 ' O ' ' A' ' 82' ' ' LYS . 11.0 m 53.75 164.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.069 0.462 . . . . 0.0 111.781 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.73 95.75 0.33 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.344 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -54.28 105.56 0.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.848 0.356 . . . . 0.0 111.08 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -138.64 121.95 17.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.865 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.7 t0 63.79 136.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 11.2 m -161.74 72.0 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.774 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.3 t 59.49 66.28 1.04 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.763 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 2.2 m -124.0 135.0 53.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.957 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -44.07 66.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.066 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -64.55 -33.54 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.985 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.05 -36.95 75.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.813 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 97' ' ' ARG . 5.8 tt -54.47 -29.68 50.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.061 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.3 OUTLIER -53.75 -29.07 38.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.183 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.75 -36.08 59.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.445 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.18 -37.6 78.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.678 0.275 . . . . 0.0 111.64 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' GLU . 1.5 ppt_? -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 110.946 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -50.95 -56.02 14.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.987 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.18 -30.49 59.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 49' ' ' PHE . 0.4 OUTLIER -59.08 -30.67 68.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.155 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.909 ' HB2' HD12 ' A' ' 8' ' ' ILE . 2.6 tt0 -72.57 -41.83 65.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -47.0 83.61 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 56' ' ' LEU . 17.5 t80 -63.91 -36.91 85.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.877 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.598 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -68.3 -41.8 80.39 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.249 0.547 . . . . 0.0 110.545 179.499 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.622 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.2 mt-30 -54.62 -23.82 18.75 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.061 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 13.2 mtt-85 -71.17 -49.83 39.69 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.838 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.49 -43.68 83.64 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.163 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.93 ' CG2' HD22 ' A' ' 4' ' ' LEU . 5.4 m -65.45 -34.13 68.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 3.3 t-20 -47.97 -58.39 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.341 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.6 ' HE1' HD13 ' A' ' 66' ' ' ILE . 15.5 m170 -102.38 124.67 38.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.54 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -71.69 -37.12 5.59 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.635 2.223 . . . . 0.0 112.881 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.48 -25.25 41.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.897 -179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.752 ' SD ' HD13 ' A' ' 115' ' ' LEU . 2.1 ppp? -57.22 -49.93 74.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.668 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.838 HD11 ' O ' ' A' ' 108' ' ' ILE . 0.3 OUTLIER -43.36 -52.55 5.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.346 -179.026 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 64.32 -70.42 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.358 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 115' ' ' LEU . 69.0 m-20 -57.59 142.27 77.69 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.7 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 17.2 Cg_exo -67.0 -21.23 49.88 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.595 2.197 . . . . 0.0 112.931 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 123' ' ' PHE . 66.3 m-20 -75.58 -51.99 11.63 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.577 0.227 . . . . 0.0 111.563 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.559 ' HA ' ' HB2' ' A' ' 123' ' ' PHE . 4.5 t -59.94 -38.73 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 121.221 0.534 . . . . 0.0 109.981 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.475 ' O ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -57.99 -29.97 65.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.929 178.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.58 3.65 15.79 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.007 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.37 -44.33 16.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.941 0.401 . . . . 0.0 111.014 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' CD1' HG12 ' A' ' 109' ' ' VAL . 2.2 pt? -51.95 -23.3 4.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.506 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.452 ' HB2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -167.12 63.86 0.09 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.811 0.339 . . . . 0.0 111.634 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.08 162.43 27.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.678 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -156.52 -77.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.932 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.946 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.878 0.371 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.579 ' HB3' HD22 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -111.09 -171.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.73 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.707 ' H ' HD13 ' A' ' 32' ' ' LEU . 1.4 t70 -93.19 47.29 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.755 HD12 HG21 ' A' ' 109' ' ' VAL . 1.3 tm? -75.72 111.21 10.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.862 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' THR . 13.5 t -126.28 119.03 26.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.788 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.704 ' CG2' HG13 ' A' ' 26' ' ' VAL . 0.3 OUTLIER -136.28 121.08 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.145 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.04 114.09 3.92 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.686 HG22 ' HG3' ' A' ' 98' ' ' ARG . 1.9 mp -76.55 116.49 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.17 0.51 . . . . 0.0 110.915 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -156.2 150.43 25.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.989 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.661 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.3 t0 111.52 -30.57 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.775 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.57 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.882 2.388 . . . . 0.0 114.443 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 3.6 pt-20 -132.38 153.45 50.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.334 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -67.63 99.96 0.84 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.66 0.743 . . . . 0.0 110.083 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.578 HD13 ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER -72.05 165.26 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.491 -1.231 . . . . 0.0 112.253 -178.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.467 ' N ' HG23 ' A' ' 14' ' ' ILE . . . 76.26 -72.8 1.86 Allowed Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.622 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.84 60.28 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.753 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 173.41 98.32 0.11 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.398 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.2 ttt 63.07 88.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 64.08 90.04 0.09 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -107.43 161.04 15.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.06 0.457 . . . . 0.0 111.452 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.8 p90 -145.51 154.74 42.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.306 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -97.42 149.1 5.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.682 0.753 . . . . 0.0 110.327 177.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.578 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -96.32 -175.92 3.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 111.575 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LYS . 7.0 m-85 -146.93 99.94 3.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.504 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HD3' ' HB1' ' A' ' 41' ' ' ALA . 5.7 tmtp? -78.57 89.83 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.036 0.446 . . . . 0.0 111.187 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.704 HG13 ' CG2' ' A' ' 6' ' ' VAL . 26.2 t -90.24 97.53 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.377 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 31.8 m -85.85 72.32 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.295 -179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.627 HG23 ' CD1' ' A' ' 4' ' ' LEU . 90.5 m -77.57 146.01 36.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.272 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -151.38 127.18 10.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.959 0.409 . . . . 0.0 111.309 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.8 t -149.0 100.51 3.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.765 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.55 61.13 6.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.769 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.707 HD13 ' H ' ' A' ' 3' ' ' ASP . 1.9 mp -137.21 160.32 66.26 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.933 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -73.89 78.04 2.58 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.61 2.207 . . . . 0.0 112.2 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.01 -65.07 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -153.57 171.09 19.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.001 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.696 HH12 HD12 ' A' ' 124' ' ' LEU . 0.2 OUTLIER 64.98 -76.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 -66.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.818 0.342 . . . . 0.0 111.002 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -67.67 -21.11 65.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.214 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 65.68 151.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.665 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.5 p90 172.06 -171.27 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.966 0.413 . . . . 0.0 111.141 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.595 ' HB1' ' HD3' ' A' ' 25' ' ' LYS . . . -115.51 172.21 7.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.47 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 69.9 t -145.59 145.49 20.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.844 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 5.9 ptpt -132.09 122.9 26.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.072 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.38 149.8 36.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.886 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.408 ' HG3' ' HB2' ' A' ' 21' ' ' TYR . 63.0 ttt180 -59.83 155.81 15.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.67 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -56.77 -27.9 60.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.071 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.2 t -68.64 -49.13 61.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.058 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.18 -48.05 77.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.922 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 101' ' ' LEU . 0.2 OUTLIER -56.86 -32.91 66.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.261 0.553 . . . . 0.0 110.728 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.7 -32.09 63.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.75 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -47.59 -39.03 15.24 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.76 -0.733 . . . . 0.0 113.671 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.862 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.74 -57.51 3.19 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-O 121.682 0.753 . . . . 0.0 110.637 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -52.76 -39.6 62.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.845 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' O ' ' CB ' ' A' ' 58' ' ' GLU . 1.3 tt0 -76.4 -43.28 41.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.84 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 32.6 mmtm -61.23 -40.71 95.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.44 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.71 ' CD1' HD11 ' A' ' 108' ' ' ILE . 2.2 mt -82.02 -38.62 24.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.61 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -76.18 -44.13 39.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.629 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.412 ' CB ' ' O ' ' A' ' 54' ' ' GLU . 42.3 tt0 -61.34 -25.75 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.448 ' O ' ' N ' ' A' ' 61' ' ' SER . 2.6 mtpm? -83.51 -37.96 22.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.477 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 44.39 -90.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.297 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 59' ' ' LYS . 14.2 p 58.13 163.3 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 0.0 111.186 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.7 -73.24 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.2 150.23 37.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.035 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -154.72 -44.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.62 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.418 ' CD2' ' CG ' ' A' ' 114' ' ' MET . 4.1 m-85 -103.07 152.06 21.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.801 0.334 . . . . 0.0 110.856 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 pt -65.13 -30.31 49.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.096 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.656 HG22 ' HD2' ' A' ' 69' ' ' PRO . 14.7 p -62.92 112.74 7.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.473 ' HB2' ' HD3' ' A' ' 69' ' ' PRO . 27.5 Cg_exo -59.17 -49.96 9.77 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.049 1.833 . . . . 0.0 112.271 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.656 ' HD2' HG22 ' A' ' 67' ' ' VAL . 39.2 Cg_exo -60.14 143.38 99.54 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.152 1.901 . . . . 0.0 111.665 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -51.59 178.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.278 1.985 . . . . 0.0 112.194 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.468 ' HB3' ' HD3' ' A' ' 107' ' ' ARG . 80.7 Cg_exo -46.15 -65.41 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.657 2.238 . . . . 0.0 112.17 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -179.55 106.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.74 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.74 138.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.971 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -113.39 108.52 17.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.66 167.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.062 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.486 HD12 ' HD2' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -130.72 -44.33 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.923 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.6 -105.53 3.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.654 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -85.91 156.54 20.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.767 0.318 . . . . 0.0 110.935 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.824 HG21 ' OE2' ' A' ' 95' ' ' GLU . 2.0 p -79.93 -43.73 21.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.853 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp 60.82 157.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.901 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.4 m 41.79 72.42 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.678 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -167.75 154.89 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.898 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.3 t -111.45 -41.35 4.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 113.49 63.28 0.43 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -103.15 67.23 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.875 0.369 . . . . 0.0 110.858 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.22 -179.95 5.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.888 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.809 ' O ' ' HB2' ' A' ' 91' ' ' ALA . 2.3 m-20 -54.37 173.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.013 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.8 -28.56 11.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 39.6 p -57.43 -30.72 65.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.05 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 54.2 p -170.93 67.65 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.832 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 87' ' ' ASP . . . -72.05 -46.11 58.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 96' ' ' LYS . 1.3 pt-20 -69.81 -29.37 66.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -57.23 -48.49 78.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.3 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 94' ' ' LEU . 7.3 tp -59.94 -48.18 82.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.48 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.824 ' OE2' HG21 ' A' ' 79' ' ' THR . 13.9 pt-20 -71.06 -49.34 45.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.3 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.486 ' HD2' HD12 ' A' ' 76' ' ' ILE . 0.2 OUTLIER -60.9 -52.42 65.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.815 0.341 . . . . 0.0 111.006 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 tpt85 -59.11 -31.6 69.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.686 ' HG3' HG22 ' A' ' 8' ' ' ILE . 33.2 ttp180 -67.56 -53.33 29.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.199 0.523 . . . . 0.0 110.197 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.04 20.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.931 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 103' ' ' ARG . . . -52.14 -30.38 26.33 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.053 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.542 HD13 ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -59.95 -30.95 69.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.305 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.573 ' CA ' HD13 ' A' ' 8' ' ' ILE . 78.6 tt0 -72.84 -55.26 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.469 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -57.25 -43.87 83.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.948 -179.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -60.55 -32.36 71.43 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.075 179.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.676 ' O ' HG13 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -83.44 -34.97 25.33 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.256 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.691 ' HA ' HG22 ' A' ' 109' ' ' VAL . 7.5 mm100 -54.59 -37.92 66.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.209 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.605 ' HD2' ' HE1' ' A' ' 114' ' ' MET . 0.0 OUTLIER -61.41 -37.51 83.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 110.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.71 HD11 ' CD1' ' A' ' 56' ' ' LEU . 42.7 mt -77.23 -47.7 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.251 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.755 HG21 HD12 ' A' ' 4' ' ' LEU . 2.4 m -63.62 -27.45 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.016 0.436 . . . . 0.0 110.319 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.16 -59.06 5.89 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.188 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.529 ' O ' HD13 ' A' ' 115' ' ' LEU . 2.0 m170 -102.78 129.07 26.52 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.133 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.38 -43.3 1.51 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.302 2.001 . . . . 0.0 112.369 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -27.01 42.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.587 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.605 ' HE1' ' HD2' ' A' ' 107' ' ' ARG . 2.6 ttp -55.46 -26.22 41.0 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.765 0.316 . . . . 0.0 111.01 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.966 HD23 ' HA ' ' A' ' 121' ' ' ARG . 5.5 mp -58.14 -52.86 63.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.63 -67.46 0.14 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.612 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.649 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -56.99 120.32 37.6 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.962 -179.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.14 -22.23 24.85 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.445 2.097 . . . . 0.0 112.595 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 123' ' ' PHE . 0.8 OUTLIER -75.23 -51.19 13.9 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.913 0.387 . . . . 0.0 110.742 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.862 HG13 HD13 ' A' ' 52' ' ' LEU . 2.9 t -59.83 -39.73 80.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.84 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.966 ' HA ' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -57.03 -29.87 63.74 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.696 178.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -115.16 13.07 16.72 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.697 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 52' ' ' LEU . 17.6 t80 -81.92 -48.18 11.83 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.696 HD12 HH12 ' A' ' 36' ' ' ARG . 0.2 OUTLIER -73.48 -9.89 59.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.545 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.18 20.26 15.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.605 0.241 . . . . 0.0 111.084 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 155.47 18.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.906 0.384 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -133.73 23.23 3.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.035 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.444 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.789 0.328 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.628 ' HA ' HD22 ' A' ' 32' ' ' LEU . 37.7 p90 -145.07 141.66 29.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.051 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.567 ' H ' HD13 ' A' ' 32' ' ' LEU . 21.3 m-20 -62.81 140.92 58.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.126 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.896 HD12 ' CG2' ' A' ' 109' ' ' VAL . 0.6 OUTLIER -152.25 113.96 4.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.367 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.6 m -134.42 98.54 4.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.54 -179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.587 HG21 HG13 ' A' ' 26' ' ' VAL . 1.4 m -104.97 166.92 3.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.21 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.57 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -144.41 113.27 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.502 HG22 ' HG2' ' A' ' 98' ' ' ARG . 1.9 mp -81.81 116.18 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.754 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.664 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 17.0 m -156.6 138.44 14.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.055 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 9' ' ' THR . 45.9 t0 121.87 -31.94 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.721 0 O-C-N 123.445 0.466 . . . . 0.0 112.123 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 11.5 Cg_exo -37.09 105.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.646 2.23 . . . . 0.0 113.62 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.657 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -139.54 171.5 14.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.839 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.588 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -68.85 139.77 55.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.777 0.322 . . . . 0.0 110.374 179.672 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.614 HD12 ' O ' ' A' ' 12' ' ' GLU . 1.0 OUTLIER -135.26 -46.99 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.674 -178.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.474 ' O ' ' CB ' ' A' ' 16' ' ' ASP . . . -38.81 -89.43 0.01 OUTLIER Glycine 0 CA--C 1.52 0.345 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.743 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 15' ' ' GLY . 16.8 t70 89.13 87.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.814 0.446 . . . . 0.0 110.823 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.95 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.517 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.5 mmt 64.36 20.97 12.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.786 0.327 . . . . 0.0 111.14 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -178.65 44.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.186 0.517 . . . . 0.0 110.168 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.588 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -55.2 152.94 7.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.184 -179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -121.48 159.72 25.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.019 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.657 HG13 ' N ' ' A' ' 12' ' ' GLU . 70.2 t -111.1 152.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.616 0.722 . . . . 0.0 111.241 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.44 ' N ' ' CG1' ' A' ' 22' ' ' VAL . . . -106.61 130.9 54.28 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.612 -1.177 . . . . 0.0 110.965 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.649 ' CE2' HD12 ' A' ' 101' ' ' LEU . 18.2 m-85 -94.85 127.27 40.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.096 0.475 . . . . 0.0 111.836 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 9' ' ' THR . 3.7 tppp? -104.22 88.76 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.85 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.587 HG13 HG21 ' A' ' 6' ' ' VAL . 45.7 t -91.24 96.28 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.436 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 89.3 m -87.63 84.68 7.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.069 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.525 HG23 HD11 ' A' ' 4' ' ' LEU . 99.3 m -85.23 144.43 28.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.423 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 39' ' ' GLN . 3.5 pt20 -139.8 127.09 21.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.153 0.501 . . . . 0.0 111.3 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 36' ' ' ARG . 2.4 t -157.6 100.34 1.78 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.162 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.7 m -58.56 -26.02 63.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.844 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.628 HD22 ' HA ' ' A' ' 2' ' ' PHE . 1.7 mp -57.76 149.39 53.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.569 ' O ' HD12 ' A' ' 34' ' ' LEU . 56.2 Cg_endo -69.75 -158.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.612 2.208 . . . . 0.0 111.891 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 33' ' ' PRO . 0.3 OUTLIER 80.47 -58.23 0.32 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.174 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 36' ' ' ARG . 3.3 m-85 -147.28 160.21 42.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.937 0.399 . . . . 0.0 111.33 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.935 ' NH1' HD11 ' A' ' 124' ' ' LEU . 0.0 OUTLIER 66.29 -71.39 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.285 179.609 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.6 t 67.25 -70.1 0.12 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.968 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.45 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -94.43 11.82 29.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.189 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 29' ' ' GLN . 1.1 pt20 51.98 168.88 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.968 0.413 . . . . 0.0 111.801 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.433 ' CZ ' ' HD3' ' A' ' 36' ' ' ARG . 9.3 p90 169.25 -162.02 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.173 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' VAL . . . -144.65 162.37 36.84 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.291 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.614 HG23 ' HD2' ' A' ' 44' ' ' ARG . 3.1 m -133.72 153.13 36.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.244 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' CE ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -102.67 119.19 38.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.205 179.152 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.614 ' HD2' HG23 ' A' ' 42' ' ' VAL . 0.4 OUTLIER -140.88 125.69 18.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.191 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -175.11 0.05 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.318 179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' HD12 ' A' ' 50' ' ' LEU . 1.3 m-85 -65.74 -38.4 89.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.785 0.326 . . . . 0.0 111.17 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 11.5 t -69.09 -41.89 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.749 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.436 ' CB ' ' HB2' ' A' ' 44' ' ' ARG . 0.7 OUTLIER -53.97 -51.1 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.421 -179.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.47 ' HE2' HG21 ' A' ' 26' ' ' VAL . 0.8 OUTLIER -71.38 -27.53 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 0.0 110.828 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.504 HD23 ' OE2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -55.6 -32.1 62.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.322 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -47.8 -40.39 18.66 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.701 -0.761 . . . . 0.0 113.312 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.86 HD21 ' CD2' ' A' ' 123' ' ' PHE . 9.7 mt -83.82 -57.4 3.22 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.551 0.691 . . . . 0.0 110.616 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 104' ' ' TYR . 9.0 t80 -53.0 -40.5 63.85 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.775 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.504 ' OE2' HD23 ' A' ' 50' ' ' LEU . 17.3 tt0 -76.46 -46.97 24.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.215 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -61.56 -49.32 77.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.535 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.687 HD23 ' NH1' ' A' ' 107' ' ' ARG . 8.2 mp -67.82 -40.85 83.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 65.9 m -69.33 -34.08 74.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.79 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -74.98 -42.76 56.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.811 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.7 tpmp? -75.11 -43.24 53.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.4 ' ND1' ' HE3' ' A' ' 73' ' ' LYS . 1.0 OUTLIER 66.52 -72.16 0.09 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.972 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m -67.25 -51.37 53.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.84 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.86 96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.787 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -59.38 116.95 4.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.83 -55.87 0.64 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.596 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.586 ' CE2' ' HG2' ' A' ' 114' ' ' MET . 4.0 t80 -110.05 126.24 53.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.873 0.368 . . . . 0.0 111.084 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.658 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -143.26 41.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.841 179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -76.53 123.65 87.75 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.125 -179.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.559 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 17.4 Cg_endo -63.34 -30.08 72.88 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.568 2.179 . . . . 0.0 114.625 -179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 67' ' ' VAL . 74.8 Cg_exo -48.87 -169.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.346 2.031 . . . . 0.0 112.819 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.509 ' HB2' ' HD3' ' A' ' 71' ' ' PRO . 86.6 Cg_exo -42.28 -45.99 7.6 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.72 2.28 . . . . 0.0 114.048 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.591 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 74.5 Cg_exo -49.18 89.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.161 1.908 . . . . 0.0 112.512 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 70' ' ' PRO . 3.1 pt-20 -167.86 -177.12 3.3 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.719 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HE3' ' ND1' ' A' ' 60' ' ' HIS . 0.5 OUTLIER -95.54 -31.87 13.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.7 t -65.13 78.97 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 tt -176.29 -52.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 76' ' ' ILE . 17.7 tt -155.34 97.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.66 -66.36 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.409 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.7 mtm 61.27 28.51 18.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.696 0.284 . . . . 0.0 111.198 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.63 -152.82 0.39 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.713 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.8 85.78 0.11 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.909 0.385 . . . . 0.0 110.931 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.1 m -103.99 143.64 15.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.047 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt 59.58 63.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.711 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 83' ' ' VAL . 12.8 p -57.6 123.63 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -125.33 11.35 7.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.839 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -62.99 104.59 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.793 0.33 . . . . 0.0 110.881 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 153.9 19.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.947 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -172.03 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.9 t -171.4 -70.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.902 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.4 t -163.34 -171.5 2.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 60.2 p -166.52 91.73 0.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.931 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.69 -43.42 66.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.06 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.97 -41.79 67.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -63.79 -53.0 57.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.003 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 94' ' ' LEU . 12.0 tp -60.92 -32.83 72.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.842 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.98 -45.2 43.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -72.73 -28.91 62.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -59.09 -31.94 69.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.896 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.502 ' HG2' HG22 ' A' ' 8' ' ' ILE . 8.8 mtp180 -66.58 -53.2 37.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.54 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.04 25.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.445 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -54.65 -31.76 58.04 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.263 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.649 HD12 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -60.26 -37.57 80.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.981 0.42 . . . . 0.0 109.929 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.499 ' N ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -72.2 -40.96 67.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.081 179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 mmm-85 -58.0 -46.07 85.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.509 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 17.5 t80 -70.13 -30.48 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.568 178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' ILE . 1.9 tm? -82.35 -28.6 31.46 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.654 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.2 mt-30 -61.02 -35.92 78.15 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.687 ' NH1' HD23 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -65.03 -50.26 66.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.72 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -67.66 -32.41 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.056 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.896 ' CG2' HD12 ' A' ' 4' ' ' LEU . 28.1 m -83.99 -22.83 8.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.934 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 0.8 OUTLIER -70.89 -51.68 24.74 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 30.1 t60 -102.79 137.1 19.22 Favored Pre-proline 0 N--CA 1.462 0.134 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.524 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.402 ' HA ' HD23 ' A' ' 115' ' ' LEU . 54.8 Cg_endo -71.05 -50.12 0.35 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.537 2.158 . . . . 0.0 112.593 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.3 m -61.54 -25.45 67.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.619 ' HB2' ' HB3' ' A' ' 111' ' ' HIS . 2.9 mtp -58.68 -49.79 76.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.252 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 115' ' ' LEU . 2.9 mm? -44.83 -52.19 8.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.09 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.42 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.475 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -57.64 122.99 60.2 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.87 -179.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 -24.42 33.66 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.51 2.14 . . . . 0.0 112.661 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.462 ' HB3' ' CE2' ' A' ' 123' ' ' PHE . 3.8 m-20 -64.97 -53.11 51.47 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.257 0.551 . . . . 0.0 110.99 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.77 HG23 HD13 ' A' ' 52' ' ' LEU . 2.5 p -70.31 -36.54 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.264 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -29.96 70.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.147 177.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -114.5 13.35 17.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.86 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -82.23 -48.6 11.06 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.901 0.381 . . . . 0.0 111.05 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' NH1' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.35 -28.64 69.37 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -90.4 -16.47 29.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.179 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -52.58 121.69 7.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.866 0.365 . . . . 0.0 111.008 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.432 ' HG2' HG12 ' A' ' 42' ' ' VAL . 1.6 mt-10 -128.34 99.26 5.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.887 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.816 0.341 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.935 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 1.8 t80 57.71 -111.8 0.61 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.449 ' CB ' ' CD2' ' A' ' 32' ' ' LEU . 12.2 t70 176.76 -31.5 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.725 0.298 . . . . 0.0 111.106 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.859 HD22 HG21 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -39.9 107.12 0.06 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.889 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 89.9 m -127.41 97.24 4.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.863 HG22 ' HA ' ' A' ' 28' ' ' THR . 28.6 t -98.66 150.77 4.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.249 0.547 . . . . 0.0 111.569 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -131.69 112.68 1.22 Allowed Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.583 HD12 ' N ' ' A' ' 102' ' ' GLU . 79.6 mt -89.08 116.84 31.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.063 0.459 . . . . 0.0 110.893 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.607 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 3.6 m -155.81 143.92 19.91 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.094 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.63 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 5.4 m-20 116.35 -31.86 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.479 0.712 . . . . 0.0 112.093 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 43.4 Cg_exo -41.11 98.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.413 2.075 . . . . 0.0 113.368 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.447 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.8 pt-20 -126.66 172.39 10.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.769 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -68.87 99.75 1.09 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.639 HG21 ' CE1' ' A' ' 21' ' ' TYR . 5.3 mm -70.16 151.72 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.653 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 64.93 -67.67 0.07 OUTLIER Glycine 0 N--CA 1.453 -0.175 0 CA-C-N 115.835 -0.62 . . . . 0.0 113.118 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 14' ' ' ILE . 15.9 t0 75.08 101.47 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.902 0.382 . . . . 0.0 110.884 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -171.69 -107.99 0.21 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.173 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.01 -56.41 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.338 . . . . 0.0 110.592 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.07 70.13 1.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.315 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -74.95 156.26 36.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.509 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.639 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.3 p90 -122.21 168.03 12.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.347 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 12' ' ' GLU . 52.9 t -114.2 142.45 26.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.432 0.634 . . . . 0.0 110.145 178.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -86.81 168.86 13.09 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.351 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.932 ' CE2' HD22 ' A' ' 101' ' ' LEU . 14.0 m-85 -137.96 109.2 6.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.273 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -90.35 89.01 7.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.941 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.623 HG13 HG11 ' A' ' 6' ' ' VAL . 43.7 t -87.85 89.5 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.076 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 6.8 m -85.68 83.46 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.084 -179.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.863 ' HA ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -80.33 138.24 36.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.97 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 0.4 OUTLIER -139.27 105.52 5.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.618 179.389 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.734 HG21 ' HB2' ' A' ' 36' ' ' ARG . 3.6 t -139.13 99.67 3.82 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.301 0.572 . . . . 0.0 110.859 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.6 m -102.8 44.05 1.04 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.536 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' CD2' ' CB ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -97.72 166.06 14.3 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.948 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 32' ' ' LEU . 4.4 Cg_endo -46.05 -32.18 9.55 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.853 2.369 . . . . 0.0 112.347 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.935 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.5 OUTLIER -84.07 -28.54 27.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.489 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.549 ' O ' ' CB ' ' A' ' 36' ' ' ARG . 61.4 m-85 69.21 -123.8 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.799 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.734 ' HB2' HG21 ' A' ' 30' ' ' THR . 3.5 mmt-85 105.26 -26.1 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.811 0.844 . . . . 0.0 109.743 -178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.4 t 164.89 82.3 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.327 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.3 -44.04 0.58 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.349 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' GLN . 30.7 tt0 177.06 113.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.469 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -148.88 -167.73 2.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.453 0.644 . . . . 0.0 111.657 179.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -153.6 121.93 6.2 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.732 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.53 141.59 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 0.0 111.463 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -121.75 119.57 32.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.787 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -152.86 153.76 33.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.719 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -71.03 162.97 28.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.762 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -56.92 -28.61 62.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.84 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.0 t -64.06 -32.24 73.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 1.8 m-20 -67.3 -51.22 55.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.885 ' CD1' HD11 ' A' ' 101' ' ' LEU . 13.0 t80 -73.25 -27.34 61.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.904 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 54' ' ' GLU . 6.0 tt -55.38 -33.6 63.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.234 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -52.83 -28.26 30.92 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.439 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.023 HD13 HG13 ' A' ' 120' ' ' VAL . 1.5 mt -83.47 -58.65 2.73 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.58 0.705 . . . . 0.0 110.026 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -38.83 64.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.495 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 50' ' ' LEU . 2.0 pp20? -76.64 -42.9 40.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.23 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 11.3 ttmt -69.06 -49.2 59.48 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.442 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.719 HD12 ' OH ' ' A' ' 104' ' ' TYR . 88.6 mt -60.88 -32.61 72.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.705 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 t -76.13 -31.58 58.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -52.61 -25.35 10.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.64 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -53.64 -23.96 12.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.676 0.274 . . . . 0.0 111.227 -179.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.44 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 6.5 m80 54.05 96.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.157 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.3 m -164.54 164.17 21.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.954 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -85.37 -54.16 4.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 19.7 p30 -61.33 153.29 27.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.816 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -53.4 -28.72 36.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.1 OUTLIER 177.69 -166.5 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.831 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.625 HD12 ' O ' ' A' ' 66' ' ' ILE . 2.0 pp -110.16 32.65 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.945 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.474 HG22 ' HB3' ' A' ' 65' ' ' PHE . 0.3 OUTLIER -125.03 159.0 61.14 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.039 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.584 ' HB2' ' HD2' ' A' ' 70' ' ' PRO . 11.2 Cg_endo -55.35 -175.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.584 2.19 . . . . 0.0 112.364 -179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' A' ' 68' ' ' PRO . 39.2 Cg_exo -61.15 -46.49 15.31 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.866 2.378 . . . . 0.0 114.405 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.584 ' HD2' ' HB2' ' A' ' 68' ' ' PRO . 36.6 Cg_exo -57.67 -53.29 4.72 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.143 1.896 . . . . 0.0 113.164 -178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' A' ' 70' ' ' PRO . 51.8 Cg_exo -54.76 -22.33 28.93 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.01 1.807 . . . . 0.0 112.221 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -86.81 -73.83 0.45 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.994 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 tptp 54.19 -102.1 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.787 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.697 ' C ' HD23 ' A' ' 75' ' ' LEU . 0.0 OUTLIER 46.35 -169.07 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.831 0.348 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.709 HD11 ' HD2' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -166.08 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.673 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.675 HG22 ' O ' ' A' ' 75' ' ' LEU . 1.9 tt 50.95 169.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -105.46 20.58 36.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.778 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.652 ' H ' HG23 ' A' ' 76' ' ' ILE . 7.6 mmm 61.73 116.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 49.55 77.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.017 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.44 133.86 53.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.175 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.53 HG13 ' N ' ' A' ' 82' ' ' LYS . 6.7 p -175.32 -52.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.874 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.53 ' N ' HG13 ' A' ' 81' ' ' VAL . 6.0 tptt 51.67 173.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.951 0.405 . . . . 0.0 111.717 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.731 HG12 ' H ' ' A' ' 85' ' ' LYS . 58.0 t 53.85 -83.73 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.619 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 82' ' ' LYS . . . 120.26 -26.24 7.11 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.731 ' H ' HG12 ' A' ' 83' ' ' VAL . 8.6 mmmt -110.56 -167.79 1.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.824 0.345 . . . . 0.0 110.85 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -85.28 133.14 34.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.553 ' OD1' HG11 ' A' ' 83' ' ' VAL . 4.0 p-10 -173.5 105.06 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p 67.01 11.95 8.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.569 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.3 m 46.13 30.19 0.92 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.838 0.351 . . . . 0.0 111.228 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 62.94 37.35 12.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.895 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.5 -44.75 64.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.159 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.93 -30.14 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -63.88 -36.98 85.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.798 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -37.84 55.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.144 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -33.82 72.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -80.19 -38.15 31.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.859 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.02 69.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.901 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -43.47 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.767 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.65 89.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.742 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.95 65.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.943 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.932 HD22 ' CE2' ' A' ' 24' ' ' TYR . 7.1 tp -59.64 -28.8 67.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.49 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.583 ' N ' HD12 ' A' ' 8' ' ' ILE . 3.7 tm-20 -70.82 -47.36 59.85 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HD2' HD11 ' A' ' 75' ' ' LEU . 3.9 mmt180 -57.8 -41.32 81.92 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.719 ' OH ' HD12 ' A' ' 56' ' ' LEU . 30.6 t80 -70.23 -30.33 67.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.934 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.718 ' O ' HG22 ' A' ' 109' ' ' VAL . 1.9 tm? -81.58 -31.24 32.66 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.613 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.638 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 5.4 mt-30 -61.92 -41.66 98.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.72 0.295 . . . . 0.0 111.346 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 104' ' ' TYR . 0.4 OUTLIER -58.03 -49.39 77.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.285 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.956 ' O ' HD11 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.9 -47.87 73.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.99 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.859 HG21 HD22 ' A' ' 4' ' ' LEU . 26.9 m -62.94 -30.53 49.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.095 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 106' ' ' GLN . 27.3 t-20 -55.47 -69.51 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.325 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.497 ' O ' ' CD1' ' A' ' 115' ' ' LEU . 10.3 t-80 -103.05 135.89 19.33 Favored Pre-proline 0 C--O 1.226 -0.154 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.757 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.425 ' HD2' ' CD2' ' A' ' 111' ' ' HIS . 58.4 Cg_endo -71.26 -28.8 18.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.511 2.14 . . . . 0.0 113.124 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.4 m -77.96 -27.48 49.21 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 2.3 tmm? -62.92 -21.29 65.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.686 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.956 HD11 ' O ' ' A' ' 108' ' ' ILE . 5.2 mp -80.2 -52.85 7.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.635 0.255 . . . . 0.0 111.145 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 67.84 -62.91 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.467 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.624 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.2 OUTLIER -57.16 123.8 62.43 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 -179.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.31 -26.17 42.25 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.237 . . . . 0.0 112.694 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 123' ' ' PHE . 6.9 m-20 -75.4 -46.21 34.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 120.909 0.385 . . . . 0.0 110.806 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.023 HG13 HD13 ' A' ' 52' ' ' LEU . 17.4 t -59.51 -44.66 93.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.162 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.644 ' HA ' HD22 ' A' ' 115' ' ' LEU . 3.5 tpt85 -55.39 -29.67 58.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.124 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -111.54 3.49 18.05 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.542 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.46 -46.45 13.45 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.146 -179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.757 HD13 HG12 ' A' ' 109' ' ' VAL . 1.7 pp -65.47 -26.49 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.97 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -106.34 22.84 15.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.128 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.43 123.81 22.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.819 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -149.29 131.79 15.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.924 179.935 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.832 0.348 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.468 ' CZ ' HD11 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -127.81 -166.43 1.61 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.926 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.62 ' CB ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -125.28 21.38 7.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.415 -179.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 109' ' ' VAL . 8.9 tt -95.4 115.25 27.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.6 m -113.34 121.96 45.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.8 OUTLIER -137.29 124.7 30.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -107.4 112.78 3.79 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 120.256 -0.973 . . . . 0.0 111.367 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.695 HG22 ' HB2' ' A' ' 98' ' ' ARG . 10.5 mt -94.07 119.45 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 10' ' ' ASP . 1.4 t -146.53 124.4 11.96 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -178.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 1.7 m-20 52.08 147.25 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.26 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.821 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.85 ' HB2' HG11 ' A' ' 22' ' ' VAL . 12.3 Cg_endo -106.51 101.12 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.296 1 C-N-CA 125.746 4.298 . . . . 0.0 111.319 -178.444 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' HG13 ' A' ' 22' ' ' VAL . 2.1 pm0 -84.75 145.45 27.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.112 0.482 . . . . 0.0 111.612 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.521 ' C ' HD13 ' A' ' 14' ' ' ILE . 16.2 tptm -68.97 146.31 52.85 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.254 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.87 HD11 ' CB ' ' A' ' 23' ' ' ALA . 3.7 mm -103.25 -31.41 2.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.406 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.82 -177.75 15.06 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.551 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 p-10 -173.82 36.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.83 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -122.5 -58.45 0.2 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.542 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.3 mtt -146.16 -62.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.809 0.337 . . . . 0.0 110.86 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -105.18 66.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.601 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.7 149.46 21.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.442 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -144.04 177.65 8.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.454 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.85 HG11 ' HB2' ' A' ' 11' ' ' PRO . 88.0 t -110.3 153.15 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.667 0.746 . . . . 0.0 111.067 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.87 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -112.2 -175.34 2.66 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.54 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -133.94 128.98 35.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.964 0.411 . . . . 0.0 111.243 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -79.67 88.2 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.888 -179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.34 82.76 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.057 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.537 HG23 ' HB2' ' A' ' 41' ' ' ALA . 1.3 m -85.42 68.82 10.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.003 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 79.0 m -73.69 147.49 43.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.749 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -145.87 107.4 4.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -124.75 100.24 6.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.231 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 t -71.18 -13.77 62.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.62 HD13 ' CB ' ' A' ' 3' ' ' ASP . 7.9 mp -72.59 161.99 76.36 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.607 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.0 62.28 1.34 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.468 HD11 ' CZ ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -101.74 -69.86 0.77 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.098 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -165.27 -67.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.479 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 38' ' ' LYS . 1.8 mmm180 -47.51 -60.3 2.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.277 -179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t 64.93 -68.43 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.8 OUTLIER -61.81 -26.19 67.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.198 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 69.91 134.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.881 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -178.99 -168.19 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.537 ' HB2' HG23 ' A' ' 27' ' ' THR . . . -120.56 160.84 22.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.792 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.96 142.69 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.065 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' HB1' ' A' ' 23' ' ' ALA . 6.5 mmtt -90.56 119.88 31.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 0.0 111.243 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -113.61 143.01 45.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.13 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.4 165.13 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.01 -42.05 81.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.006 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -66.54 -47.84 71.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.178 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.41 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 5.4 m-20 -58.26 -51.32 70.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -61.17 -37.2 82.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.178 0.513 . . . . 0.0 110.493 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -55.85 -32.98 64.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.906 179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.26 -52.01 19.25 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.082 -0.58 . . . . 0.0 113.498 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.063 HD13 HG13 ' A' ' 120' ' ' VAL . 1.9 mt -67.38 -35.59 79.63 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.434 0.635 . . . . 0.0 109.787 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.414 ' HD2' HD13 ' A' ' 50' ' ' LEU . 34.3 t80 -58.68 -55.26 37.39 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.117 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.88 -41.59 43.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.948 -179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -59.5 -49.03 79.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.459 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 mm? -56.55 -46.66 80.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 0.0 111.176 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -76.14 -32.94 59.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.05 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.88 -37.52 86.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.217 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' O ' ' N ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -59.11 -46.43 88.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.009 -179.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.5 m80 42.85 -92.68 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.428 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 59' ' ' LYS . 3.2 m 45.91 78.05 0.07 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 111.479 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.0 -158.88 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.82 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -41.89 153.44 0.06 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.427 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -37.77 -91.93 0.01 OUTLIER Glycine 0 C--N 1.333 0.367 0 CA-C-N 116.09 -0.504 . . . . 0.0 113.272 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.624 ' C ' HD12 ' A' ' 66' ' ' ILE . 0.5 OUTLIER -114.19 -79.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.581 0.229 . . . . 0.0 110.966 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.624 HD12 ' C ' ' A' ' 65' ' ' PHE . 4.2 mp -148.87 -59.71 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.756 0.312 . . . . 0.0 111.188 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.657 HG23 ' CG ' ' A' ' 70' ' ' PRO . 0.0 OUTLIER -113.79 126.6 27.86 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.059 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.494 ' N ' ' CD ' ' A' ' 69' ' ' PRO . 36.3 Cg_exo -58.52 -41.22 67.07 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.843 2.362 . . . . 0.0 113.97 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.502 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 52.3 Cg_exo -53.08 -56.81 2.44 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.414 2.076 . . . . 0.0 114.23 -178.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.657 ' CG ' HG23 ' A' ' 67' ' ' VAL . 6.1 Cg_exo -45.95 -57.55 2.13 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 121.873 1.716 . . . . 0.0 112.678 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.505 ' HD3' ' CB ' ' A' ' 70' ' ' PRO . 50.8 Cg_exo -50.76 -164.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.365 2.043 . . . . 0.0 112.478 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.47 ' HG2' ' HD2' ' A' ' 107' ' ' ARG . 1.5 pp20? -102.65 -156.59 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.546 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HD2' HG23 ' A' ' 76' ' ' ILE . 0.1 OUTLIER -49.04 177.41 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.001 0.429 . . . . 0.0 111.457 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -55.41 5.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.707 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 75' ' ' LEU . 6.9 tp 179.51 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.622 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.4 HG23 ' HD2' ' A' ' 73' ' ' LYS . 16.4 pt 44.14 87.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 111.66 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 172.35 141.85 3.56 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.44 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 2.3 mtp 62.73 31.35 16.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.931 0.396 . . . . 0.0 110.881 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.62 -78.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -110.74 -24.35 10.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.171 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 5.9 m -52.61 178.12 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.298 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.98 22.28 7.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.176 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.6 t 68.01 -68.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.182 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 101.25 -153.5 19.0 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.496 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.71 30.23 19.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -153.03 125.27 8.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.799 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -60.67 -167.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.2 t 66.66 108.24 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.952 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.4 m 60.91 88.42 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.6 t -152.97 23.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.115 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.16 -46.04 58.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.283 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -71.95 -36.35 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.987 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -57.33 -37.06 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.42 -34.98 67.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -77.99 -47.6 18.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.027 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -51.09 -29.38 13.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.889 0.376 . . . . 0.0 111.116 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.4 mtt85 -58.98 -31.33 68.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.018 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.695 ' HB2' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -55.37 -35.81 65.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.342 0.591 . . . . 0.0 110.753 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.55 -56.15 13.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.328 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.01 72.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.093 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.8 -47.16 86.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.482 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.6 ' CA ' HD12 ' A' ' 8' ' ' ILE . 35.1 tt0 -72.83 -40.87 65.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.199 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -47.77 81.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.497 ' HA ' ' HD2' ' A' ' 107' ' ' ARG . 0.2 OUTLIER -70.82 -41.32 71.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.58 179.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.561 HD23 HG11 ' A' ' 6' ' ' VAL . 1.2 tp -60.2 -39.68 87.42 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.368 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.613 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.9 mt-30 -54.78 -30.49 56.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.94 0.4 . . . . 0.0 110.709 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 104' ' ' TYR . 13.0 mtp180 -69.95 -47.48 62.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.099 0.476 . . . . 0.0 109.786 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.804 HG23 ' HG ' ' A' ' 115' ' ' LEU . 2.7 mp -64.85 -47.33 88.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.628 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 4' ' ' LEU . 16.5 m -64.35 -36.82 78.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.905 0.383 . . . . 0.0 110.104 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -51.13 -68.61 0.16 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.396 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.472 ' O ' ' HG2' ' A' ' 114' ' ' MET . 0.4 OUTLIER -102.12 127.26 31.24 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.289 -179.536 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.878 ' O ' HD22 ' A' ' 115' ' ' LEU . 61.7 Cg_endo -72.35 -43.3 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.815 2.343 . . . . 0.0 113.85 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.6 m -75.75 -31.47 59.57 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.64 ' HE2' ' HA ' ' A' ' 108' ' ' ILE . 2.3 ptt? -54.99 -29.35 57.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.923 0.392 . . . . 0.0 111.753 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.878 HD22 ' O ' ' A' ' 112' ' ' PRO . 0.0 OUTLIER -56.42 -52.34 65.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.808 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 115' ' ' LEU . 8.2 tt0 68.69 -64.13 0.33 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.677 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 118' ' ' PRO . 6.5 m-20 -58.03 124.08 67.9 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.699 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 117' ' ' ASP . 37.3 Cg_exo -58.0 -26.69 76.13 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.621 2.214 . . . . 0.0 113.122 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 1.2 m-20 -75.52 -51.72 12.31 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.446 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.063 HG13 HD13 ' A' ' 52' ' ' LEU . 5.3 t -59.37 -31.81 47.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.666 ' HD2' HD23 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -59.07 -29.91 67.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.81 178.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.89 -3.23 11.67 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 112.011 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.6 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 7.3 m-30 -82.58 -25.63 33.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.938 0.399 . . . . 0.0 111.303 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.618 HD12 ' HB2' ' A' ' 125' ' ' GLU . 3.6 pp -51.94 -25.1 7.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.294 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.618 ' HB2' HD12 ' A' ' 124' ' ' LEU . 4.1 mm-40 -146.32 -72.19 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.862 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -46.77 159.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.305 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 3.0 mt-10 -76.6 -67.91 0.65 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.912 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.921 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.771 0.319 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.669 ' O ' HD23 ' A' ' 32' ' ' LEU . 0.9 OUTLIER -156.98 -42.41 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.265 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB3' HD23 ' A' ' 32' ' ' LEU . 9.9 t0 47.99 77.61 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.394 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.742 HD22 ' CB ' ' A' ' 109' ' ' VAL . 0.3 OUTLIER -111.27 112.67 24.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.786 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 15.0 t -114.45 117.66 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.099 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.797 HG21 HG13 ' A' ' 26' ' ' VAL . 0.4 OUTLIER -136.28 140.41 43.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -118.91 113.1 2.47 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.484 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.719 HG22 ' HG2' ' A' ' 98' ' ' ARG . 3.1 mt -95.12 118.02 40.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 10' ' ' ASP . 11.5 m -142.98 124.38 14.72 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.414 ' O ' ' O ' ' A' ' 9' ' ' THR . 1.8 m-20 52.69 146.03 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.541 178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.839 ' HB2' HG11 ' A' ' 22' ' ' VAL . 18.3 Cg_endo -108.79 99.03 0.02 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.274 1 C-N-CA 125.865 4.377 . . . . 0.0 112.028 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.93 144.12 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.899 0.381 . . . . 0.0 111.457 -179.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.637 ' C ' HD12 ' A' ' 14' ' ' ILE . 8.1 ttpt -74.74 134.84 41.81 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.782 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 13' ' ' LYS . 1.5 mp -117.24 134.02 62.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.169 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 73.82 177.91 36.54 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.79 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -174.2 85.35 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.864 0.364 . . . . 0.0 110.818 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.14 75.27 0.2 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.519 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.2 ptt? 44.96 30.0 0.52 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.438 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -179.31 41.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . . . -76.49 159.08 30.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.241 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CE1' ' CG2' ' A' ' 14' ' ' ILE . 3.7 p90 -144.38 172.04 13.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.451 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.839 HG11 ' HB2' ' A' ' 11' ' ' PRO . 79.0 t -105.61 145.13 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 121.524 0.678 . . . . 0.0 110.49 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -97.88 -175.81 3.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.758 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.522 ' CE2' ' HG ' ' A' ' 101' ' ' LEU . 6.8 m-85 -139.79 122.53 16.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.18 179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.598 ' NZ ' ' HB1' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -77.5 88.43 3.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.116 0.484 . . . . 0.0 110.211 -179.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.797 HG13 HG21 ' A' ' 6' ' ' VAL . 14.4 t -110.15 87.5 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.729 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 86.8 m -85.81 71.86 10.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.093 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.722 ' HA ' ' HB ' ' A' ' 6' ' ' VAL . 17.8 m -73.49 147.08 44.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.162 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 1.6 tt0 -151.43 134.24 15.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.431 0.634 . . . . 0.0 111.872 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.602 HG22 ' HG3' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -146.2 100.21 3.35 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.709 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.8 t -58.61 -21.02 52.27 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.329 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 2' ' ' PHE . 4.2 mm? -41.93 114.52 1.35 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.208 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.21 0.09 8.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.585 2.19 . . . . 0.0 113.196 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.491 HD23 HD12 ' A' ' 32' ' ' LEU . 2.6 pp -93.91 -17.2 23.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.511 0.196 . . . . 0.0 111.455 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.07 141.77 18.95 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.542 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 0.3 OUTLIER 66.61 -77.13 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.805 178.715 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 69.1 m 63.39 -77.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.659 0.266 . . . . 0.0 111.087 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -69.24 64.96 0.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 0.0 110.686 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.602 ' HG3' HG22 ' A' ' 30' ' ' THR . 11.8 mm100 -86.37 -178.82 6.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.608 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.466 ' N ' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER 167.4 -113.06 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.333 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.598 ' HB1' ' NZ ' ' A' ' 25' ' ' LYS . . . -151.51 152.54 33.11 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-O 120.857 0.36 . . . . 0.0 111.304 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -140.91 166.39 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.242 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.429 ' NZ ' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -110.84 119.19 38.29 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' A' ' 49' ' ' PHE . 1.2 tpp85 -134.09 142.27 47.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.102 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 23.0 ptt180 -78.06 162.49 26.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.721 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -67.7 -28.09 67.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.102 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.22 -46.68 82.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.333 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.04 -50.82 15.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.968 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.648 ' CZ ' HG21 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -56.89 -41.41 78.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.24 0.543 . . . . 0.0 110.885 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.676 HD21 ' OE2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -55.36 -32.74 62.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.881 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.38 -34.48 13.44 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.08 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.059 HD13 HG13 ' A' ' 120' ' ' VAL . 6.6 mt -83.3 -55.71 4.18 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.648 0.737 . . . . 0.0 110.058 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.92 -39.92 63.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.753 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.676 ' OE2' HD21 ' A' ' 50' ' ' LEU . 0.8 OUTLIER -76.27 -42.41 45.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.609 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 1.1 mtpt -65.13 -48.49 73.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.345 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 52' ' ' LEU . 6.1 mp -50.27 -42.91 53.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.105 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.0 t -76.22 -44.36 37.95 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.423 ' HG2' ' HA ' ' A' ' 55' ' ' LYS . 5.7 pt-20 -75.05 -48.2 25.14 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.8 OUTLIER -57.04 -46.21 82.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.194 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 1.0 OUTLIER 178.54 102.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.167 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.94 137.57 36.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 62.7 -131.64 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.486 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -50.58 117.11 2.24 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.853 0.358 . . . . 0.0 111.205 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.64 42.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.517 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.49 ' N ' ' CD1' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -165.68 88.38 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.676 0.274 . . . . 0.0 111.092 -179.877 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.538 ' CD1' HG22 ' A' ' 113' ' ' THR . 0.5 OUTLIER 42.07 -89.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.854 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.615 HG22 ' HD2' ' A' ' 69' ' ' PRO . 10.9 p -62.5 109.7 2.62 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 120.397 0.142 . . . . 0.0 111.123 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.445 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 4.6 Cg_exo -42.6 -54.22 3.34 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.867 2.378 . . . . 0.0 112.975 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.615 ' HD2' HG22 ' A' ' 67' ' ' VAL . 63.2 Cg_exo -36.9 112.81 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.056 2.504 . . . . 0.0 113.177 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.405 ' CB ' ' CD ' ' A' ' 71' ' ' PRO . 63.2 Cg_exo -51.82 -175.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.699 2.266 . . . . 0.0 112.402 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.421 ' O ' ' N ' ' A' ' 73' ' ' LYS . 14.9 Cg_exo -68.93 58.18 1.15 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.866 2.377 . . . . 0.0 112.646 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 50.45 -88.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.492 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 71' ' ' PRO . 0.0 OUTLIER -123.83 -172.93 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.11 -79.19 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.67 100.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.926 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 76' ' ' ILE . 10.3 tt -149.22 46.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.977 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.0 101.9 0.85 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.48 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 1.6 ptp -115.27 -38.42 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.843 0.354 . . . . 0.0 110.923 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -151.72 -79.72 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.01 171.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.572 HG13 ' O ' ' A' ' 81' ' ' VAL . 9.6 p -178.42 65.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.053 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -116.95 134.77 54.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.093 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 84' ' ' GLY . 11.1 p -168.24 156.22 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.446 ' N ' HG22 ' A' ' 83' ' ' VAL . . . 127.81 -48.77 0.95 Allowed Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.497 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.2 73.33 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.819 0.342 . . . . 0.0 110.887 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -140.02 125.9 19.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -80.68 60.83 4.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.737 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 3.5 m -83.97 -19.75 34.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.042 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.54 99.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.86 0.362 . . . . 0.0 111.045 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.2 m 61.07 35.51 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.109 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.737 ' HB2' ' CB ' ' A' ' 88' ' ' SER . . . -72.06 -46.21 57.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.103 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -84.18 -26.01 29.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.042 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -50.11 -52.88 31.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.063 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.652 HD13 ' HG2' ' A' ' 11' ' ' PRO . 16.2 mt -57.7 -29.91 65.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -71.05 -49.98 38.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -57.04 14.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 28.9 ttt180 -59.31 -31.61 69.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.793 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.719 ' HG2' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -66.27 -53.39 37.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.524 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -55.46 -52.78 62.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.002 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -49.93 -30.21 9.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.221 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.522 ' HG ' ' CE2' ' A' ' 24' ' ' TYR . 0.2 OUTLIER -59.13 -47.42 85.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.589 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.527 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -73.11 -37.44 66.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.692 0.282 . . . . 0.0 111.044 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -57.81 -48.65 79.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.936 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.644 ' CE1' HD11 ' A' ' 108' ' ' ILE . 0.5 OUTLIER -71.38 -45.7 62.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 0.0 110.817 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.69 HD22 HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -57.95 -49.09 77.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.636 -179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.678 ' HA ' HG22 ' A' ' 109' ' ' VAL . 1.0 OUTLIER -54.62 -30.88 56.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.504 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -69.62 -37.73 76.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.804 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.906 ' HA ' ' HE3' ' A' ' 114' ' ' MET . 0.0 OUTLIER -78.37 -47.23 24.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.127 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.742 ' CB ' HD22 ' A' ' 4' ' ' LEU . 9.6 m -62.1 -32.86 55.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 110.108 178.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -42.13 -71.37 0.08 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.571 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 16.7 t60 -102.85 122.47 45.66 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.058 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.459 ' HA ' ' CD1' ' A' ' 115' ' ' LEU . 20.3 Cg_endo -60.78 -26.45 83.06 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.295 1.997 . . . . 0.0 112.118 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.538 HG22 ' CD1' ' A' ' 66' ' ' ILE . 0.2 OUTLIER -79.16 -33.03 44.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.325 -179.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.906 ' HE3' ' HA ' ' A' ' 108' ' ' ILE . 3.5 tmm? -56.95 -56.51 20.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.285 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 108' ' ' ILE . 1.2 mp -47.12 -52.9 14.2 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.63 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 61.72 -64.48 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.554 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.7 OUTLIER -55.55 123.27 49.87 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.654 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.19 -23.62 30.34 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.665 2.243 . . . . 0.0 112.682 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.7 m-20 -74.71 -49.61 20.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.006 0.431 . . . . 0.0 110.409 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.059 HG13 HD13 ' A' ' 52' ' ' LEU . 24.1 t -59.68 -46.32 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.783 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.26 -29.68 58.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.831 178.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -113.01 13.17 19.41 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.995 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.882 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -82.15 -48.27 11.52 Favored 'General case' 0 C--N 1.334 -0.085 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.195 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.567 HD22 HG12 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -75.02 -25.66 58.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.166 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.408 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 2.8 tt0 -103.74 30.65 4.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.89 149.5 26.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.774 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -124.78 58.21 1.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.85 179.845 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.3 pm0 . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.833 0.349 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.809 ' HA ' HD21 ' A' ' 32' ' ' LEU . 39.8 p90 -68.86 180.0 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.838 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.46 149.79 51.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.996 0.426 . . . . 0.0 111.331 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.793 HD22 ' CB ' ' A' ' 109' ' ' VAL . 2.4 tt -164.27 99.03 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 m -116.4 103.88 10.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.779 HG11 ' CD2' ' A' ' 105' ' ' LEU . 0.8 OUTLIER -101.55 136.4 33.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.318 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.72 113.09 4.12 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.139 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.859 HD12 ' N ' ' A' ' 102' ' ' GLU . 56.2 mt -99.26 117.75 44.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.498 ' HA ' ' HD3' ' A' ' 98' ' ' ARG . 1.3 m -145.77 124.04 12.27 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.1 147.56 0.04 OUTLIER Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.395 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.854 ' HB2' HG11 ' A' ' 22' ' ' VAL . 11.8 Cg_endo -106.02 109.09 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.32 1 C-N-CA 125.727 4.285 . . . . 0.0 111.401 -178.255 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' O ' HG13 ' A' ' 22' ' ' VAL . 7.7 pt-20 -84.69 132.15 34.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.3 tptt -68.98 146.29 52.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.674 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.787 HD11 ' HB2' ' A' ' 23' ' ' ALA . 2.4 mm -123.62 153.79 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.18 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 68.62 -62.67 0.45 Allowed Glycine 0 CA--C 1.517 0.216 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.874 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 21.3 t0 75.52 139.2 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.849 0.356 . . . . 0.0 110.994 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.84 -139.12 11.26 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.519 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.55 -15.67 25.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.752 0.31 . . . . 0.0 111.073 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -131.63 67.51 1.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.243 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -111.16 158.43 18.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.569 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.544 ' CE1' HG21 ' A' ' 14' ' ' ILE . 8.0 p90 -138.2 150.92 47.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.059 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.854 HG11 ' HB2' ' A' ' 11' ' ' PRO . 91.8 t -95.66 144.84 9.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.687 0.756 . . . . 0.0 111.334 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB2' HD11 ' A' ' 14' ' ' ILE . . . -96.92 -175.84 3.39 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.193 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.787 ' CE2' HD12 ' A' ' 101' ' ' LEU . 3.2 m-85 -145.27 114.18 6.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.972 0.415 . . . . 0.0 110.884 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -78.3 91.76 4.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.817 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.743 HG12 HG12 ' A' ' 8' ' ' ILE . 14.5 m -104.08 93.0 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.749 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 59.1 m -85.24 75.88 10.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.12 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.662 HG23 HD21 ' A' ' 4' ' ' LEU . 23.3 m -73.66 114.55 12.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.953 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -112.79 125.58 54.5 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.51 0.672 . . . . 0.0 111.176 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.822 HG23 ' HG3' ' A' ' 33' ' ' PRO . 0.7 OUTLIER -157.74 105.12 1.99 Allowed 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.106 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.9 t -82.3 2.28 32.81 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.718 -178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.009 HD22 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.47 44.59 0.33 Allowed Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.822 ' HG3' HG23 ' A' ' 30' ' ' THR . 64.4 Cg_endo -91.61 -10.72 2.49 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.619 2.212 . . . . 0.0 112.61 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER 62.5 23.08 13.69 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -177.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.36 -76.9 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.066 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -71.5 -46.82 58.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.687 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 m 66.55 -66.19 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.607 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -20.11 56.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.92 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 63.67 160.32 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 12.4 p90 170.1 -170.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.462 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.51 168.46 9.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.646 HG13 HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -162.17 128.86 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.297 179.558 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -90.16 119.52 30.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.811 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 123' ' ' PHE . 0.0 OUTLIER -107.34 148.95 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.079 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.5 153.74 23.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -42.12 68.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.874 0.369 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.1 p -69.46 -41.46 76.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.079 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -66.45 -51.16 59.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.176 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.679 ' CD2' HD13 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.92 -32.51 67.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.028 0.442 . . . . 0.0 110.655 179.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.07 -32.58 74.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.253 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 55' ' ' LYS . . . -48.0 -31.92 8.56 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.03 -0.605 . . . . 0.0 113.242 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.88 HD13 HG23 ' A' ' 120' ' ' VAL . 2.6 mt -83.3 -53.95 5.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.607 0.717 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -53.36 -44.83 68.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.083 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -39.52 54.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.389 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 51' ' ' GLY . 2.0 ttpm? -68.96 -36.14 77.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.819 0.342 . . . . 0.0 110.911 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.631 HD13 ' CZ ' ' A' ' 65' ' ' PHE . 3.3 mm? -69.42 -41.77 75.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.883 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -76.2 -44.01 39.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.38 -33.9 75.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.42 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -60.46 -27.76 67.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.152 -179.672 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.406 ' CG ' ' O ' ' A' ' 59' ' ' LYS . 74.1 m80 -157.86 130.68 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.386 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -81.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.549 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.42 -40.07 3.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.773 0.32 . . . . 0.0 111.316 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -52.04 122.04 7.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.136 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -59.82 85.53 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.425 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.631 ' CZ ' HD13 ' A' ' 56' ' ' LEU . 1.4 m-85 61.57 -82.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.655 0.264 . . . . 0.0 110.989 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.1 mt -152.26 -49.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 111.057 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.801 HG23 ' CD ' ' A' ' 70' ' ' PRO . 15.2 m -96.93 170.58 7.13 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.01 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.491 ' CD ' ' HB ' ' A' ' 67' ' ' VAL . 27.1 Cg_exo -64.36 -46.07 8.28 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.968 2.445 . . . . 0.0 114.37 -178.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.576 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 91.1 Cg_exo -42.62 -49.07 6.74 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.793 2.329 . . . . 0.0 113.627 -178.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.801 ' CD ' HG23 ' A' ' 67' ' ' VAL . 96.8 Cg_exo -40.35 -177.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.147 2.565 . . . . 0.0 113.557 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' A' ' 70' ' ' PRO . 87.6 Cg_exo -47.68 150.91 3.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.632 2.221 . . . . 0.0 112.736 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -155.65 166.62 32.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.873 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mttp 64.0 -80.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.15 94.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.056 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -116.97 43.31 2.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.736 HG21 ' CB ' ' A' ' 100' ' ' ALA . 14.3 mt -107.33 -19.37 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.314 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.3 -101.49 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.921 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.426 ' O ' ' N ' ' A' ' 80' ' ' LYS . 4.8 mtm 58.18 -88.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.422 0.154 . . . . 0.0 110.743 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 p 44.98 -90.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.506 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 78' ' ' MET . 0.4 OUTLIER 59.01 179.77 0.08 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.949 0.404 . . . . 0.0 111.202 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.8 m -81.97 -167.23 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.097 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp 63.7 115.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.871 0.367 . . . . 0.0 111.058 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 21.9 t -135.42 74.66 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 93.25 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.605 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -176.81 126.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.851 0.358 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.45 -179.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.064 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 t0 75.36 -167.19 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 45.8 t -53.54 -68.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.079 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.16 -73.23 0.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.804 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.421 ' HB3' ' CD1' ' A' ' 93' ' ' PHE . 38.4 t -178.84 133.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.68 -46.09 59.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.067 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -25.88 68.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.266 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.421 ' CD1' ' HB3' ' A' ' 90' ' ' SER . 0.2 OUTLIER -49.85 -52.09 35.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.421 HD23 ' HG2' ' A' ' 11' ' ' PRO . 1.2 tp -63.25 -29.9 71.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 98' ' ' ARG . 0.4 OUTLIER -69.66 -50.0 48.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 -179.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.6 -24.98 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.425 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mmm-85 -69.16 -35.31 76.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.546 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.565 ' NH1' ' HB2' ' A' ' 99' ' ' ALA . 0.0 OUTLIER -67.91 -35.69 78.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.437 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.565 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . . . -61.65 -45.58 93.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.94 0.4 . . . . 0.0 110.722 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.736 ' CB ' HG21 ' A' ' 76' ' ' ILE . . . -64.22 -31.04 72.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.323 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.787 HD12 ' CE2' ' A' ' 24' ' ' TYR . 5.9 mt -59.81 -41.13 90.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.713 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.859 ' N ' HD12 ' A' ' 8' ' ' ILE . 70.0 tt0 -72.88 -36.7 67.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.9 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -63.56 -48.45 77.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.053 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -71.03 -39.62 72.21 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.512 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.779 ' CD2' HG11 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -60.67 -42.07 96.31 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.913 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 109' ' ' VAL . 5.1 mt-30 -54.86 -31.72 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 0.0 110.334 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -71.13 -43.82 66.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.822 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.785 HG21 ' CG2' ' A' ' 120' ' ' VAL . 3.6 mt -67.78 -37.99 79.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.105 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.93 HG12 ' CD2' ' A' ' 124' ' ' LEU . 2.5 m -77.49 -29.79 16.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.31 -62.01 2.18 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.505 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.4 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 50.0 m170 -102.47 120.79 52.06 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.368 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.02 -49.66 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.297 1.998 . . . . 0.0 112.234 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -23.35 64.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.121 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.424 ' O ' ' CE2' ' A' ' 65' ' ' PHE . 3.1 ttt -53.42 -37.87 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.465 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.67 HD22 HG23 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -96.33 -52.41 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.261 -179.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER 48.73 27.01 1.4 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.578 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.471 ' CB ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -109.75 123.89 35.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.399 179.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -56.32 -26.76 63.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.68 2.254 . . . . 0.0 113.534 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 123' ' ' PHE . 15.3 m-20 -75.1 -53.34 9.05 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.88 0.371 . . . . 0.0 111.863 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.88 HG23 HD13 ' A' ' 52' ' ' LEU . 2.3 p -70.58 -39.74 76.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -58.51 -29.89 66.62 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.025 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -98.8 -15.64 19.19 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.092 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.609 ' CD2' HD11 ' A' ' 52' ' ' LEU . 74.3 t80 -62.52 -48.07 81.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.927 0.394 . . . . 0.0 110.677 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.93 ' CD2' HG12 ' A' ' 109' ' ' VAL . 1.8 mp -55.64 -22.65 23.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.584 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -128.62 28.59 5.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.662 0.267 . . . . 0.0 111.676 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -95.55 158.18 15.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.558 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -165.86 116.17 1.02 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.926 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.831 179.97 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.851 0.357 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.816 ' CE1' HD22 ' A' ' 34' ' ' LEU . 2.9 t80 -93.55 -21.55 19.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.126 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.709 ' HB2' HD13 ' A' ' 32' ' ' LEU . 6.4 m-20 64.46 29.29 13.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.277 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.702 HD22 ' HB ' ' A' ' 109' ' ' VAL . 6.2 tt -101.04 140.08 35.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.874 0.369 . . . . 0.0 110.997 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 58.4 m -155.47 106.42 2.54 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.631 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.806 HG21 HG13 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -110.96 165.62 6.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.104 0.478 . . . . 0.0 111.527 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.553 ' N ' HG23 ' A' ' 6' ' ' VAL . . . -148.03 113.35 0.63 Allowed Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.581 HD13 ' N ' ' A' ' 102' ' ' GLU . 3.7 mp -80.0 115.72 22.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.118 0.459 . . . . 0.0 111.205 -178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.658 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 7.9 m -157.2 138.81 14.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.495 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.658 ' CB ' ' O ' ' A' ' 9' ' ' THR . 11.6 t70 110.2 -30.67 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.897 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 7.2 Cg_exo -36.57 108.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.757 2.305 . . . . 0.0 114.75 -178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.3 pt-20 -119.92 154.12 34.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.758 -1.11 . . . . 0.0 108.718 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HE3' ' HB3' ' A' ' 20' ' ' ALA . 7.1 tptt -68.55 102.58 1.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.437 0.637 . . . . 0.0 110.927 -179.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.869 ' O ' ' HB1' ' A' ' 20' ' ' ALA . 5.2 mm -63.28 161.76 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.431 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 45.02 -159.14 0.17 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 121.167 -0.539 . . . . 0.0 113.305 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.438 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -178.27 -177.79 0.6 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.737 0.303 . . . . 0.0 110.841 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.99 75.78 1.27 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.745 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 35.42 35.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.602 0.361 . . . . 0.0 111.947 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.2 t30 178.75 82.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.742 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 14' ' ' ILE . . . -139.23 159.71 41.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.36 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.614 ' O ' ' N ' ' A' ' 14' ' ' ILE . 4.3 p90 -136.31 153.18 51.23 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.153 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.2 OUTLIER -99.14 139.81 20.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.606 0.717 . . . . 0.0 109.907 177.497 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.25 152.48 29.06 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.734 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' HD2' HD12 ' A' ' 101' ' ' LEU . 13.6 m-85 -111.68 101.68 10.04 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.833 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.86 ' HE2' ' HB1' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -79.4 88.94 4.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.144 0.497 . . . . 0.0 110.607 179.894 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.806 HG13 HG21 ' A' ' 6' ' ' VAL . 21.4 t -93.11 96.16 5.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.334 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 41' ' ' ALA . 90.7 m -85.39 74.26 10.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 111.093 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.548 HG21 HD11 ' A' ' 4' ' ' LEU . 89.9 m -81.63 142.77 32.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.352 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -136.81 99.84 4.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.845 0.355 . . . . 0.0 111.063 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 36' ' ' ARG . 1.2 t -127.8 99.62 5.61 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.219 0.533 . . . . 0.0 110.099 179.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -24.14 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.879 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.726 HD22 ' O ' ' A' ' 2' ' ' PHE . 7.5 mp -60.85 124.23 78.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.11 82.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.36 2.04 . . . . 0.0 111.828 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.816 HD22 ' CE1' ' A' ' 2' ' ' PHE . 1.1 mp -134.26 -67.81 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.429 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.418 ' O ' ' HD2' ' A' ' 36' ' ' ARG . 75.1 m-85 -148.59 56.87 1.04 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' HB2' HG23 ' A' ' 30' ' ' THR . 5.3 mmm180 -167.0 -62.75 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.998 0.427 . . . . 0.0 110.61 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.2 t 69.5 -62.51 0.41 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.001 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -95.0 -24.35 16.97 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 7.2 mt-30 68.22 132.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.449 ' CE1' ' CZ ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -178.05 -160.41 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.013 0.435 . . . . 0.0 111.829 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.86 ' HB1' ' HE2' ' A' ' 25' ' ' LYS . . . -105.9 142.55 35.42 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.082 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.607 HG21 ' HB2' ' A' ' 125' ' ' GLU . 73.1 t -110.54 143.12 21.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.284 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD3' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -112.39 119.27 37.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.16 179.147 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -154.2 145.4 22.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.216 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.5 ptt-85 -71.25 169.25 15.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 8.1 t80 -58.68 -35.56 72.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.013 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 m -59.02 -31.0 68.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.418 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 5.9 m-20 -67.68 -51.34 50.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.376 -179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.449 ' CE1' ' CD2' ' A' ' 101' ' ' LEU . 7.4 t80 -75.09 -26.31 59.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.376 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' CZ ' ' A' ' 46' ' ' PHE . 0.5 OUTLIER -54.26 -32.99 57.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.006 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LYS . . . -48.57 -38.88 22.06 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.565 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.956 HD13 HG13 ' A' ' 120' ' ' VAL . 6.4 mt -83.15 -49.89 9.02 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.693 0.759 . . . . 0.0 110.236 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.94 -46.08 67.96 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.073 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -76.48 -33.62 58.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.28 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 51' ' ' GLY . 10.0 mmtm -69.22 -49.2 58.57 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.783 0.325 . . . . 0.0 111.64 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' CZ ' ' A' ' 104' ' ' TYR . 11.2 mp -72.5 -28.6 62.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.31 -44.29 96.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.835 0.35 . . . . 0.0 110.924 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.36 -47.92 25.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -39.99 95.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.087 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.3 t60 63.26 170.7 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.738 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.98 114.0 26.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.917 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -173.3 -49.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -116.19 147.01 41.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.771 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.59 -51.77 1.08 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.544 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -80.85 -44.43 18.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.689 0.28 . . . . 0.0 111.027 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 mm 71.23 -61.41 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.439 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.636 HG23 ' HD2' ' A' ' 69' ' ' PRO . 31.0 m -59.66 137.7 89.81 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.98 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.614 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 53.8 Cg_endo -96.38 18.3 0.61 Allowed 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.98 2.454 . . . . 0.0 116.039 -178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.636 ' HD2' HG23 ' A' ' 67' ' ' VAL . 45.8 Cg_exo -54.01 -168.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.416 1.411 . . . . 0.0 111.874 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.498 ' HD2' ' CB ' ' A' ' 69' ' ' PRO . 91.2 Cg_exo -42.57 -43.0 8.47 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.55 2.167 . . . . 0.0 113.84 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HD2' ' HB2' ' A' ' 69' ' ' PRO . 41.9 Cg_exo -57.6 91.58 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.228 1.952 . . . . 0.0 112.115 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.422 ' O ' ' CG ' ' A' ' 73' ' ' LYS . 17.4 pt-20 -167.19 -38.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.263 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER 50.09 -177.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.51 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.44 43.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.819 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 tp 62.97 132.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.028 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.575 ' H ' HD12 ' A' ' 76' ' ' ILE . 3.6 mp -90.11 95.41 5.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.07 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.92 -171.46 9.56 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.327 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.68 19.5 1.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.649 0.261 . . . . 0.0 111.153 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.431 HG22 ' H ' ' A' ' 80' ' ' LYS . 0.2 OUTLIER 50.78 -166.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.775 0.321 . . . . 0.0 111.149 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.431 ' H ' HG22 ' A' ' 79' ' ' THR . 5.7 mttm -143.05 138.81 30.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.885 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.582 ' O ' HG23 ' A' ' 81' ' ' VAL . 27.0 m -79.59 110.65 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.26 107.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -47.84 -80.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.42 -179.871 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.532 ' H ' HG23 ' A' ' 83' ' ' VAL . . . 79.05 -58.73 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.805 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -80.64 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.572 0.225 . . . . 0.0 111.174 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.27 130.04 38.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.897 0.379 . . . . 0.0 111.037 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -137.82 -50.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.3 t 62.18 -80.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.997 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.5 p -179.98 156.09 0.63 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -97.94 -31.25 12.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.852 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.04 97.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.46 -35.97 80.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.92 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.32 -36.87 74.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.91 -29.71 60.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.037 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.62 -31.09 45.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.055 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -66.58 -34.76 78.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.429 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 101' ' ' LEU . 27.2 mmm-85 -69.23 -31.99 70.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.067 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -74.93 -53.44 9.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.853 0.358 . . . . 0.0 110.932 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.64 -55.97 26.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.567 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 103' ' ' ARG . . . -52.88 -29.97 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.881 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -59.16 -33.49 70.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.15 -178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.581 ' N ' HD13 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -72.31 -50.24 28.46 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.048 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 16.6 ptt85 -57.44 -44.88 85.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 5.2 t80 -64.2 -30.26 71.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.121 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 109' ' ' VAL . 0.4 OUTLIER -83.18 -37.82 23.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.414 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 1.4 mm-40 -58.43 -35.29 71.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.746 -178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' TYR . 5.4 ptp180 -63.88 -49.43 72.76 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.479 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -64.02 -44.0 97.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.81 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 105' ' ' LEU . 2.8 m -73.42 -24.93 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.75 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -56.16 -62.9 1.39 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.177 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.466 ' O ' ' CD2' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -102.24 148.73 35.83 Favored Pre-proline 0 C--N 1.331 -0.205 0 C-N-CA 121.235 -0.186 . . . . 0.0 111.368 -179.016 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 111' ' ' HIS . 41.6 Cg_endo -67.55 -47.83 1.89 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.648 2.232 . . . . 0.0 112.074 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 90.4 m -67.86 -24.42 65.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.705 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' A' ' 108' ' ' ILE . 2.6 mmm -57.33 -31.28 65.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.888 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 121' ' ' ARG . 2.8 mm? -71.86 -52.74 15.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.079 0.466 . . . . 0.0 110.361 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 63.87 -77.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.189 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.421 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.4 OUTLIER -65.07 127.1 92.5 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.613 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 -22.48 14.62 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.34 2.027 . . . . 0.0 112.476 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 123' ' ' PHE . 7.9 m-20 -75.31 -50.82 14.83 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.35 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.956 HG13 HD13 ' A' ' 52' ' ' LEU . 6.4 t -58.84 -36.38 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.649 -179.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.502 ' HA ' ' HG ' ' A' ' 115' ' ' LEU . 1.6 tpt180 -59.92 -29.54 68.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.838 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.4 ' OE2' ' CE1' ' A' ' 35' ' ' PHE . 61.3 mt-10 -122.22 12.34 10.24 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.843 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.626 ' HB2' ' HA ' ' A' ' 120' ' ' VAL . 0.1 OUTLIER -82.53 -32.06 28.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.094 0.473 . . . . 0.0 111.047 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.685 HD13 HG11 ' A' ' 109' ' ' VAL . 0.5 OUTLIER -52.91 -29.15 26.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.636 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.607 ' HB2' HG21 ' A' ' 42' ' ' VAL . 9.8 pt-20 -135.13 22.72 3.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.51 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 123' ' ' PHE . 0.1 OUTLIER -61.73 142.29 57.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.792 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -96.63 -34.69 11.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.865 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.567 ' HE1' HD13 ' A' ' 34' ' ' LEU . 22.7 t80 58.11 -110.3 0.51 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.742 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 173.08 37.14 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.693 0.282 . . . . 0.0 111.141 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.746 HD11 ' CG2' ' A' ' 28' ' ' THR . 3.9 tt -110.19 144.19 39.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.635 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 5' ' ' THR . 15.1 t -142.89 117.58 9.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 0.0 111.501 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.539 ' HB ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -141.85 120.48 9.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.59 179.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -109.59 116.53 4.55 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 102' ' ' GLU . 1.6 mp -76.55 114.37 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 0.0 110.823 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.609 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 0.2 OUTLIER -157.99 153.9 26.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.494 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.609 ' CB ' ' O ' ' A' ' 9' ' ' THR . 67.2 m-20 105.3 -29.5 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.114 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 10' ' ' ASP . 0.7 OUTLIER -34.22 97.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.9 2.4 . . . . 0.0 114.729 -178.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 22' ' ' VAL . 5.0 pt-20 -120.24 154.38 34.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.594 -1.184 . . . . 0.0 108.512 178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HG3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -68.64 105.55 2.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.505 0.669 . . . . 0.0 111.103 -179.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' ' O ' ' A' ' 21' ' ' TYR . 5.1 mm -67.35 163.97 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.268 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.45 ' N ' HG22 ' A' ' 14' ' ' ILE . . . 72.03 -94.49 0.62 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.043 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.7 77.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.916 0.389 . . . . 0.0 110.818 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 157.07 -29.06 0.52 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.399 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.9 ttt -159.26 97.43 1.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.77 0.319 . . . . 0.0 110.587 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 59.04 64.99 1.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.037 0.446 . . . . 0.0 110.345 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.444 ' HB1' ' HG3' ' A' ' 13' ' ' LYS . . . -76.74 142.13 40.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.993 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 14' ' ' ILE . 3.7 p90 -138.82 152.22 47.69 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.028 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -98.81 147.12 7.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.37 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.409 ' N ' ' CG2' ' A' ' 22' ' ' VAL . . . -92.98 -179.33 5.08 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.925 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.517 ' HA ' ' HG3' ' A' ' 11' ' ' PRO . 4.3 m-85 -140.16 101.15 4.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.124 179.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 9' ' ' THR . 0.8 OUTLIER -77.44 89.1 3.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.192 0.52 . . . . 0.0 111.44 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.885 HG23 ' HB ' ' A' ' 42' ' ' VAL . 0.2 OUTLIER -92.55 95.91 5.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.712 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.589 ' O ' HG22 ' A' ' 27' ' ' THR . 49.4 m -85.3 67.17 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.079 0.466 . . . . 0.0 110.651 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.746 ' CG2' HD11 ' A' ' 4' ' ' LEU . 13.5 m -73.28 137.22 44.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.472 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -145.02 120.54 10.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.947 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 t -140.33 100.34 3.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.649 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.588 ' O ' HD12 ' A' ' 32' ' ' LEU . 4.5 t -82.11 60.28 4.82 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.817 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 3' ' ' ASP . 4.2 mp -132.11 148.85 71.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.781 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.49 67.63 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.57 2.18 . . . . 0.0 112.195 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' HE1' ' A' ' 2' ' ' PHE . 2.3 mp -146.77 -60.33 0.29 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.12 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -152.09 165.22 35.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.231 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.412 HH12 HD11 ' A' ' 124' ' ' LEU . 3.4 mmp_? 67.39 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.111 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 69.25 -64.85 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.089 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.2 mtmm -80.02 -23.99 41.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.255 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 66.29 162.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.827 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 p90 171.88 -174.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.868 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . . . -102.08 164.72 11.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.332 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.885 ' HB ' HG23 ' A' ' 26' ' ' VAL . 3.6 t -147.47 139.8 18.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.784 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 9.0 ptpt -127.29 121.18 30.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.999 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.21 127.36 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.108 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 171.74 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.077 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -62.79 -36.0 81.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.7 m -54.81 -48.96 72.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.413 ' O ' ' CE1' ' A' ' 123' ' ' PHE . 4.4 t70 -71.02 -51.12 27.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.693 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -57.91 -27.43 63.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.971 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.487 ' HA ' ' HB3' ' A' ' 53' ' ' TYR . 6.3 tt -55.36 -33.07 63.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.611 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.35 -55.97 9.95 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.764 -0.731 . . . . 0.0 113.275 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.075 HD13 HG13 ' A' ' 120' ' ' VAL . 1.2 mt -78.92 -36.41 41.91 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' LEU . 10.3 t80 -53.7 -48.71 69.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.976 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.03 -37.27 58.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -69.06 -43.25 75.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.295 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' A' ' 56' ' ' LEU . 3.2 mm? -81.98 -25.6 34.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.68 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.6 t -56.5 -31.48 64.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.663 0.268 . . . . 0.0 110.778 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.18 -41.2 92.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -46.37 8.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.897 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 58.34 113.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.361 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.856 ' O ' HD12 ' A' ' 76' ' ' ILE . 0.2 OUTLIER -98.51 -174.77 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.678 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -179.27 -72.71 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.06 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -116.09 138.36 51.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.026 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' HA2' ' CG2' ' A' ' 67' ' ' VAL . . . 141.33 -126.4 3.04 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.691 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 73.29 -62.24 0.47 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.668 0.27 . . . . 0.0 111.264 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 6.6 tt -92.1 41.78 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.85 0.357 . . . . 0.0 111.398 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.469 HG12 ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -132.32 138.5 32.37 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.189 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.491 ' N ' ' HD2' ' A' ' 69' ' ' PRO . 2.7 Cg_endo -43.23 -50.61 6.4 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.105 2.537 . . . . 0.0 113.088 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 68' ' ' PRO . 57.5 Cg_exo -35.66 151.87 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.044 2.496 . . . . 0.0 113.422 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 69' ' ' PRO . 42.0 Cg_exo -56.84 178.72 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.734 2.289 . . . . 0.0 112.575 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.46 -59.97 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.821 2.348 . . . . 0.0 112.467 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.2 72.51 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.22 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -132.47 56.45 1.83 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.839 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.484 ' O ' HD22 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -172.94 176.66 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.814 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.484 HD22 ' O ' ' A' ' 74' ' ' SER . 0.2 OUTLIER -161.85 30.37 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.091 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.856 HD12 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 46.25 -172.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.477 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.657 ' N ' HG23 ' A' ' 76' ' ' ILE . . . 124.23 -104.27 0.81 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.589 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 34.4 tpp 68.72 -67.33 0.21 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.819 0.342 . . . . 0.0 110.943 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.9 p -124.96 105.67 9.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.872 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.12 141.51 58.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.621 HG22 ' O ' ' A' ' 81' ' ' VAL . 14.7 p -140.48 35.74 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.98 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.44 129.13 55.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.7 t 63.89 67.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.05 -120.91 0.24 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.456 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -77.27 0.41 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.797 0.332 . . . . 0.0 110.869 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -146.64 171.49 15.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.929 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 t0 59.4 161.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.47 89.98 4.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.9 p -59.14 103.83 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.4 m -108.91 -31.83 7.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.95 89.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -69.02 -28.11 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -57.09 -37.21 71.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.7 -37.14 83.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.654 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -69.85 -45.33 67.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.649 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.427 ' NZ ' HG11 ' A' ' 81' ' ' VAL . 7.5 ttpp -62.07 -30.92 71.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.719 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -31.77 73.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.76 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.427 ' CD ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -65.83 -53.16 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.229 0.538 . . . . 0.0 110.215 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.52 -56.21 24.06 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.789 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.38 62.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -59.05 -42.46 90.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.077 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.804 ' HB2' HD12 ' A' ' 8' ' ' ILE . 57.7 tt0 -72.81 -41.01 65.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.014 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -57.57 -48.06 80.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.361 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -71.05 -30.65 66.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.436 178.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.956 ' HA ' HD11 ' A' ' 108' ' ' ILE . 0.3 OUTLIER -76.09 -38.67 56.7 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.641 ' HA ' ' CG2' ' A' ' 109' ' ' VAL . 0.1 OUTLIER -54.08 -24.97 19.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -178.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.629 ' HG2' HD13 ' A' ' 108' ' ' ILE . 8.3 ptm180 -71.27 -50.14 35.84 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.952 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.956 HD11 ' HA ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -68.88 -44.86 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.734 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.939 HG22 ' O ' ' A' ' 105' ' ' LEU . 0.6 OUTLIER -61.47 -35.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -48.09 -81.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 114' ' ' MET . 0.0 OUTLIER -103.21 134.43 19.78 Favored Pre-proline 0 C--N 1.333 -0.132 0 CA-C-N 116.766 -0.197 . . . . 0.0 111.142 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.31 -39.72 3.64 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.454 2.102 . . . . 0.0 112.261 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 79.1 m -78.12 -23.36 47.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.361 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.476 ' HE2' ' O ' ' A' ' 107' ' ' ARG . 8.3 tmm? -53.69 -48.01 69.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.209 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.731 ' HB3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -82.1 -50.57 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.522 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 63.42 13.85 7.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.607 0.241 . . . . 0.0 111.373 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.552 ' HB3' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER -93.11 115.4 64.91 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.79 -40.57 56.82 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.217 1.945 . . . . 0.0 112.528 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 123' ' ' PHE . 1.7 m-20 -76.48 -48.36 19.81 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.128 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.075 HG13 HD13 ' A' ' 52' ' ' LEU . 57.5 t -58.97 -41.52 83.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.417 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.43 -29.35 58.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.258 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -120.72 10.52 11.0 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.747 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -82.49 -43.92 16.6 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.777 0.323 . . . . 0.0 111.053 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.717 HD22 HG13 ' A' ' 109' ' ' VAL . 2.1 pp -60.13 -29.49 68.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.964 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.37 32.9 5.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -60.42 100.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.777 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -90.79 -29.56 17.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.036 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.827 179.987 . . . . . . . . 0 0 . 1 stop_ save_