data_2k13_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 2k13 _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 ' X' X ' 5' ' ' ASP . . . . . 0.568 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.407 -2.619 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . 0.606 ' O ' HD11 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.429 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.442 ' HB3' ' HB3' ' X' ' 68' ' ' PHE . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 16' ' ' THR . . . . . 0.455 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.538 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.459 ' HB2' ' CG ' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.535 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.568 ' HG3' ' OD1' ' X' ' 5' ' ' ASP . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.583 HG23 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 38' ' ' THR . . . . . 0.475 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' X' ' 58' ' ' VAL . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.439 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.452 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . 0.435 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . 0.657 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . 0.682 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 48' ' ' THR . . . . . 0.485 ' OG1' HG22 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . 0.436 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.453 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.586 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.583 ' CE1' HG23 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.452 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . 0.475 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.529 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.529 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . 0.468 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.498 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.442 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.436 ' HB ' ' NH2' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.513 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.682 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.435 ' OD1' ' HB ' ' X' ' 44' ' ' VAL . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . 0.606 HD11 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.497 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' X' ' 7' ' ' TRP . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.416 ' CE1' HG22 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.477 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.62 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 21' ' ' SER . . . . . 0.439 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.463 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.59 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.482 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 26' ' ' SER . . . . . 0.532 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.542 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.693 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.693 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.569 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.497 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.614 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.577 ' HB ' HD21 ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . 0.44 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.532 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.482 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.59 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.614 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 12.6 t30 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . 0.403 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.543 HG11 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.543 ' H ' HG11 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . 0.415 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . 0.415 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . 0.484 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.596 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.484 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.596 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.477 ' HA ' ' OD1' ' X' ' 12' ' ' ASN 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.531 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.41 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.422 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 4.7 t0 . . . . . 0 C--O 1.252 1.235 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.697 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.526 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.554 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.669 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.72 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.697 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.518 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.644 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' X' X ' 38' ' ' THR . . . . . 0.557 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . 0.557 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . . . . . . . . . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . 0.428 HG23 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . 0.526 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.634 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . 0.489 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . 0.634 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG3' ' HB3' ' X' ' 50' ' ' ASN . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.403 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.422 ' HA ' ' HD1' ' X' ' 22' ' ' PHE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.565 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.565 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . 0.412 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.412 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.539 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.445 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.428 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.582 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 36.5 tp . . . . . 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.427 ' HB2' ' CD1' ' X' ' 7' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.427 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.572 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.612 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . 0.411 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 21' ' ' SER . . . . . 0.485 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.615 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.538 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.68 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.511 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.68 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.648 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.717 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.501 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 38' ' ' THR . . . . . 0.433 HG23 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . 0.433 ' H ' HG23 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.717 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.549 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . 0.615 ' CD2' ' HE2' ' X' ' 22' ' ' PHE . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . 0.435 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . 0.442 ' HZ3' ' HB3' ' X' ' 51' ' ' LYS . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.538 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.549 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.546 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.546 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . 0.476 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . 0.414 HD12 HG23 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . 0.451 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.475 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.475 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.569 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . 0.505 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.492 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . 0.69 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.462 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.544 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.613 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' X' ' 20' ' ' LYS . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' X' ' 17' ' ' ASP . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.561 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.556 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.655 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.432 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.754 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.492 ' HE3' ' CH2' ' X' ' 7' ' ' TRP . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.754 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.492 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.52 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.553 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.57 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . 0.519 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.467 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.601 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.54 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.54 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.613 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . 0.425 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.469 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.52 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.69 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.442 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.402 ' CD2' HD11 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt . . . . . 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.42 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 15.7 t70 . . . . . 0 C--O 1.239 0.513 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.546 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.566 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.447 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.463 ' HG3' ' CG ' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.4 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.506 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.494 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.585 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 26' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.734 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . 0.46 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.642 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.495 HG23 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.524 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . 0.418 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . 0.585 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.54 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . 0.419 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.457 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.488 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.585 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.495 ' CE1' HG23 ' X' ' 34' ' ' THR 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.637 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.566 HG13 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.566 ' H ' HG13 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . 0.475 ' O ' HD13 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . 0.585 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.562 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.49 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.51 ' HB2' ' HZ2' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.566 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.463 ' CG ' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.436 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . 0.401 ' O ' HD12 ' X' ' 79' ' ' LEU . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.554 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.614 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.546 ' O ' HG21 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.526 ' O ' ' HE3' ' X' ' 14' ' ' LYS . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.533 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.526 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.701 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.701 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.651 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.586 HG23 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' X' ' 34' ' ' THR 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . 0.457 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.487 ' HB ' HD21 ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . 0.527 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . 0.533 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.476 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.526 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.471 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.586 ' CE2' HG23 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.487 HD21 ' HB ' ' X' ' 43' ' ' ILE . 18.6 t30 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.541 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.541 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . 0.449 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.54 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . 0.484 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.54 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . 0.546 HG21 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.417 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.41 HG22 ' ND2' ' X' ' 12' ' ' ASN . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.614 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.449 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . 0.401 HD12 ' O ' ' X' ' 6' ' ' CYS . 38.0 tp . . . . . 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.633 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . 0.734 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.633 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.541 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.557 ' HZ3' ' HB2' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.592 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.547 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.635 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.525 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.552 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.552 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.549 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.489 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . 0.443 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.443 ' HG2' ' HB3' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.635 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.649 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.544 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.544 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . 0.454 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . 0.454 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . 0.547 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.57 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.581 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.557 ' HB2' ' HZ3' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.541 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.623 ' OD1' ' HE3' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.445 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . 0.734 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.615 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.446 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . 0.563 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.463 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.636 ' NZ ' ' HB2' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . 0.448 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.439 ' HG3' HD22 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.452 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.518 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.572 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.643 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.615 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.809 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.508 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.592 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . 0.412 ' HB3' ' HG3' ' X' ' 52' ' ' GLU . 38.5 m-80 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.412 ' HG3' ' HB3' ' X' ' 50' ' ' ASN . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.572 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.809 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.592 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 13.8 t30 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.566 HG11 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.566 ' H ' HG11 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . 0.423 ' HA3' ' ND2' ' X' ' 56' ' ' ASN . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . 0.439 HD22 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . 0.491 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.549 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.466 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . 0.443 ' ND2' ' HD1' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.446 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.563 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . 0.495 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 15.5 tp . . . . . 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 7' ' ' TRP . . . . . 0.402 ' CZ3' HG23 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 9' ' ' PHE . . . . . 0.48 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 11' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 12' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' X' ' 71' ' ' ASP . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 13' ' ' ARG . . . . . 0.638 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 14' ' ' LYS . . . . . 0.638 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 20' ' ' LYS . . . . . 0.447 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 21' ' ' SER . . . . . 0.402 ' O ' HG23 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.558 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 23' ' ' LYS . . . . . 0.529 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 24' ' ' LYS . . . . . 0.452 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 26' ' ' SER . . . . . 0.422 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 27' ' ' ASP . . . . . 0.584 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 28' ' ' LEU . . . . . 0.681 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 30' ' ' GLU . . . . . 0.694 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 32' ' ' LYS . . . . . 0.681 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 33' ' ' LYS . . . . . 0.694 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 34' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 35' ' ' CYS . . . . . 0.557 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 37' ' ' LYS . . . . . 0.568 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 41' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 43' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 44' ' ' VAL . . . . . 0.402 HG23 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.627 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 52' ' ' GLU . . . . . 0.422 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 53' ' ' CYS . . . . . 0.447 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 54' ' ' TYR . . . . . 0.452 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 55' ' ' TYR . . . . . 0.529 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' O ' ' X' ' 43' ' ' ILE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 57' ' ' VAL . . . . . 0.402 HG23 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 58' ' ' VAL . . . . . 0.532 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 59' ' ' ASP . . . . . 0.532 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 67' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 68' ' ' PHE . . . . . 0.476 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 71' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 73' ' ' ASN . . . . . 0.401 HD21 ' N ' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 74' ' ' PHE . . . . . 0.627 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 75' ' ' THR . . . . . 0.48 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 76' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 77' ' ' ASN . . . . . 0.4 ' OD1' ' HE3' ' X' ' 7' ' ' TRP . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -82.46 6.72 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -110.44 97.29 6.77 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.538 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -95.73 167.97 10.95 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.317 1.056 . . . . 0.0 111.194 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.568 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER -75.98 136.43 40.01 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-N 112.662 -2.063 . . . . 0.0 105.677 165.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.606 ' O ' HD11 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.429 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.442 ' HB3' ' HB3' ' X' ' 68' ' ' PHE . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 16' ' ' THR . . . . . 0.455 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.538 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.459 ' HB2' ' CG ' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.535 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.568 ' HG3' ' OD1' ' X' ' 5' ' ' ASP . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.583 HG23 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 38' ' ' THR . . . . . 0.475 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' X' ' 58' ' ' VAL . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.439 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.452 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . 0.435 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . 0.657 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . 0.682 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 48' ' ' THR . . . . . 0.485 ' OG1' HG22 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . 0.436 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.453 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.586 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.583 ' CE1' HG23 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.452 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . 0.475 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.529 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.529 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . 0.468 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.498 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.442 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.436 ' HB ' ' NH2' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.513 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.682 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.435 ' OD1' ' HB ' ' X' ' 44' ' ' VAL . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . 0.606 HD11 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp -57.71 111.81 1.26 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 34.3 m -125.53 107.28 10.46 Favored 'General case' 0 N--CA 1.42 -1.942 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.527 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 62.6 64.28 0.93 Allowed 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 84.8 m -135.31 -70.71 0.48 Allowed 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 175.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.06 20.99 0.28 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.223 1.809 . . . . 0.0 114.258 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.65 177.81 36.01 Favored Glycine 0 N--CA 1.424 -2.157 0 N-CA-C 107.695 -2.162 . . . . 0.0 107.695 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.3 -85.03 0.54 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 117.993 0.897 . . . . 0.0 110.788 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 32.9 t70 59.58 -81.17 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.08 1.352 . . . . 0.0 110.924 -174.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.58 95.68 4.53 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . 0.482 ' O ' ' HG3' ' X' ' 4' ' ' GLU . . . -116.2 107.82 1.72 Allowed Glycine 0 N--CA 1.425 -2.087 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.375 -172.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -159.86 124.49 3.89 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -146.35 97.85 2.99 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.365 0.603 . . . . 0.0 111.717 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.0 82.69 4.23 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.582 0.705 . . . . 0.0 110.038 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -138.7 4.2 2.98 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.078 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 93' ' ' THR . . . . . 0.472 ' HB ' ' CD ' ' X' ' 46' ' ' GLU . 16.6 p -70.32 114.77 8.78 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 122.538 0.335 . . . . 0.0 110.213 -176.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 62.35 22.08 62.91 Favored Glycine 0 C--N 1.357 1.74 0 C-N-CA 119.97 -1.11 . . . . 0.0 114.128 -172.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -88.44 -33.92 17.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 117.536 0.668 . . . . 0.0 112.05 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.39 149.2 24.62 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m 76.97 91.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.092 1.757 . . . . 0.0 112.213 -178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -94.27 122.23 36.61 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' X' ' 103' ' ' ASP . 37.5 tt0 -109.4 -66.28 1.07 Allowed 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.44 176.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 44.6 t -88.79 -66.42 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.174 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -113.55 -85.8 0.58 Allowed 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -110.73 -1.49 16.66 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' X' ' 99' ' ' GLU . 3.7 p30 . . . . . 0 N--CA 1.422 -1.863 0 N-CA-C 102.738 -3.06 . . . . 0.0 102.738 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . 0.428 ' OE1' ' HE2' ' X' ' 33' ' ' LYS . 26.6 mt-10 -100.3 -41.55 7.02 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -173.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 71.5 122.64 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.006 1.322 . . . . 0.0 112.15 175.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.483 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -58.03 113.63 1.98 Allowed 'General case' 0 CA--C 1.49 -1.349 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.497 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 -64.8 -173.73 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 124.812 1.32 . . . . 0.0 112.54 -173.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' X' ' 7' ' ' TRP . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.416 ' CE1' HG22 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.477 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.62 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 21' ' ' SER . . . . . 0.439 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.463 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.59 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.482 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 26' ' ' SER . . . . . 0.532 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.542 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.693 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.693 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.569 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.497 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.614 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.577 ' HB ' HD21 ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . 0.44 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.532 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.482 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.59 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.614 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 12.6 t30 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . 0.403 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.543 HG11 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.543 ' H ' HG11 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . 0.415 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . 0.415 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . 0.484 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.596 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.484 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.596 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.477 ' HA ' ' OD1' ' X' ' 12' ' ' ASN 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.531 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.41 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp -81.48 107.83 14.57 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -128.76 147.62 50.79 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.728 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 80.11 -55.69 0.37 Allowed 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 165.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 69.1 m -62.01 -74.94 0.08 Allowed 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.453 1.1 pp20? 38.59 61.11 1.24 Allowed 'General case' 0 C--N 1.348 0.533 0 CA-C-O 123.807 1.765 . . . . 0.0 111.215 -162.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.12 92.13 0.14 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 -168.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -45.69 107.28 0.1 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.517 1.527 . . . . 0.0 114.475 -171.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -133.45 -53.31 0.89 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.207 0.527 . . . . 0.0 110.573 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.56 32.25 1.1 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.313 0.578 . . . . 0.0 110.38 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -73.15 -14.14 79.15 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.778 -176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -85.12 -12.47 52.8 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.741 0.305 . . . . 0.0 110.766 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -84.52 94.38 8.55 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 65.18 -78.87 0.03 OUTLIER 'General case' 0 C--O 1.239 0.548 0 C-N-CA 125.517 1.527 . . . . 0.0 112.519 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.81 -110.08 3.02 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 121.316 -0.469 . . . . 0.0 112.845 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.3 p -103.96 113.91 27.78 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -173.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 53.32 51.87 44.46 Favored Glycine 0 N--CA 1.475 1.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 113.941 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -123.93 96.13 4.83 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 120.046 -0.661 . . . . 0.0 111.437 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -128.67 133.49 48.24 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 27.0 m -81.42 -49.43 10.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 t70 176.32 -169.01 0.05 Allowed 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -137.31 91.55 2.62 Favored 'General case' 0 C--N 1.289 -2.046 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 176.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 2.1 t -127.58 14.99 3.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.1 t70 66.29 78.35 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.211 1.005 . . . . 0.0 108.792 -170.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -162.96 -49.12 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 113.773 -1.558 . . . . 0.0 107.045 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--N 1.311 -1.104 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.442 177.132 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.896 0.855 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.81 25.15 0.07 Allowed 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 127.183 2.193 . . . . 0.0 113.692 -174.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -93.68 -65.1 1.01 Allowed 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.534 ' HG2' ' HG2' ' X' ' 32' ' ' LYS . 24.9 mt-10 -133.79 147.96 51.31 Favored 'General case' 0 N--CA 1.426 -1.667 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.422 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 4.7 t0 -92.64 -176.24 4.21 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 176.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.697 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.513 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.526 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.518 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.554 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.669 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.72 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.697 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.518 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.644 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' X' X ' 38' ' ' THR . . . . . 0.557 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . 0.557 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . . . . . . . . . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . 0.428 HG23 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . 0.526 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.634 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . 0.489 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.634 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG3' ' HB3' ' X' ' 50' ' ' ASN . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.403 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.445 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.422 ' HA ' ' HD1' ' X' ' 22' ' ' PHE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.565 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.565 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . 0.412 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.412 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.539 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.445 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.428 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.582 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . 0.407 HD12 ' H ' ' X' ' 83' ' ' GLU . 36.5 tp -84.06 84.4 7.61 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 80' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' X' ' 81' ' ' ASP . 8.8 t -129.88 104.79 7.58 Favored 'General case' 0 C--N 1.244 -3.984 0 CA-C-N 113.489 -1.687 . . . . 0.0 106.648 167.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' X' ' 80' ' ' THR . 39.0 t70 167.69 -69.86 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.883 0.873 . . . . 0.0 109.937 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . 0.558 ' HB3' ' O ' ' X' ' 84' ' ' GLY . 97.8 m -87.0 -61.53 1.71 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.694 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . 0.407 ' H ' HD12 ' X' ' 79' ' ' LEU . 1.4 mp0 53.96 55.63 8.11 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 122.859 1.314 . . . . 0.0 108.086 -169.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . 0.558 ' O ' ' HB3' ' X' ' 82' ' ' CYS . . . 131.66 100.39 0.81 Allowed Glycine 0 N--CA 1.409 -3.14 0 N-CA-C 105.692 -2.963 . . . . 0.0 105.692 -169.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' X' ' 4' ' ' GLU . 14.4 tmtt? -50.06 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.513 1.125 . . . . 0.0 111.388 -173.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -120.18 -49.6 2.28 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.3 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.5 -31.42 72.49 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.397 0.618 . . . . 0.0 111.075 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 106.21 -32.4 7.38 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.836 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -65.31 140.65 58.71 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.034 0.445 . . . . 0.0 110.632 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.36 133.23 45.08 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -45.99 55.2 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.308 0.575 . . . . 0.0 109.725 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.44 -63.02 4.38 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 -175.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.1 t 171.33 158.2 0.08 Allowed 'General case' 0 C--O 1.254 1.295 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . 0.534 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -76.36 175.88 52.49 Favored Glycine 0 C--O 1.238 0.393 0 C-N-CA 118.59 -1.766 . . . . 0.0 112.516 176.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -156.61 -60.88 0.1 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 53.9 86.17 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.623 1.569 . . . . 0.0 113.776 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.8 m -84.12 153.34 23.79 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -80.08 89.47 5.39 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.035 0.445 . . . . 0.0 110.387 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.2 120.86 43.79 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.955 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . 0.331 11.2 p 52.09 -72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 127.291 2.236 . . . . 0.0 116.872 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -81.13 -18.17 47.36 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 121.193 -0.942 . . . . 0.0 110.817 -174.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -82.28 -31.3 30.13 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.493 -1.237 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.097 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.96 4.42 39.98 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.071 0.939 . . . . 0.0 108.504 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -112.21 122.22 47.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.568 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.576 ' O ' ' HA3' ' X' ' 88' ' ' GLY . 34.4 mt-10 -102.95 160.39 14.66 Favored 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.504 ' OD2' ' HG3' ' X' ' 85' ' ' LYS . 0.9 OUTLIER -64.9 -174.62 0.15 Allowed 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 171.314 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.738 ' SG ' ' HG2' ' X' ' 83' ' ' GLU 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.427 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.572 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.612 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . 0.411 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 21' ' ' SER . . . . . 0.485 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.615 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.538 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.68 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.511 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.68 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.648 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.717 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.501 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 38' ' ' THR . . . . . 0.433 HG23 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . 0.433 ' H ' HG23 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.717 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.549 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . 0.615 ' CD2' ' HE2' ' X' ' 22' ' ' PHE . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . 0.435 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.442 ' HZ3' ' HB3' ' X' ' 51' ' ' LYS . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.538 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.549 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.546 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.546 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . 0.476 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . 0.414 HD12 HG23 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . 0.451 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.475 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.475 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.569 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp -85.02 116.91 23.68 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -125.98 105.48 8.94 Favored 'General case' 0 N--CA 1.428 -1.563 0 C-N-CA 119.043 -1.063 . . . . 0.0 112.09 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 35.72 35.0 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 127.916 2.487 . . . . 0.0 115.599 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.4 p -86.63 -38.09 17.42 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.139 -0.975 . . . . 0.0 110.495 176.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . 0.738 ' HG2' ' SG ' ' X' ' 6' ' ' CYS . 12.7 pt-20 -172.12 -178.71 2.16 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . 0.415 ' C ' ' HD2' ' X' ' 85' ' ' LYS . . . -87.92 -96.53 0.94 Allowed Glycine 0 N--CA 1.423 -2.216 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.504 ' HG3' ' OD2' ' X' ' 5' ' ' ASP . 3.3 mptp? -138.29 77.56 1.63 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -106.51 -64.37 1.18 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.145 0.498 . . . . 0.0 110.053 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -133.42 -33.08 1.12 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' X' ' 4' ' ' GLU . . . 65.09 -131.18 36.04 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -177.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -161.99 173.49 14.36 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -98.81 138.73 35.53 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 66.46 86.1 0.14 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.849 1.343 . . . . 0.0 112.021 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.57 -32.45 2.71 Favored Glycine 0 C--N 1.307 -1.06 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.075 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 9.4 t -110.56 142.21 42.68 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 122.502 -0.411 . . . . 0.0 110.98 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.18 -61.23 1.42 Allowed Glycine 0 C--N 1.338 0.663 0 N-CA-C 114.553 0.581 . . . . 0.0 114.553 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.0 105.14 5.87 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.459 0.704 . . . . 0.0 109.699 -174.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.59 105.58 0.81 Allowed 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 14.9 m -134.2 141.88 47.2 Favored 'General case' 0 N--CA 1.425 -1.689 0 O-C-N 123.696 0.622 . . . . 0.0 110.334 -174.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -89.45 158.76 17.59 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -103.11 -51.27 3.29 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.92 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 m -129.53 73.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 63.64 -72.43 0.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.536 1.535 . . . . 0.0 114.231 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.01 -57.81 4.95 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.268 2.07 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 178.664 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.224 0.059 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -130.65 -10.39 3.99 Favored 'General case' 0 CA--C 1.511 -0.552 0 O-C-N 122.225 -0.297 . . . . 0.0 111.456 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 72.25 152.06 0.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.726 0.811 . . . . 0.0 112.781 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.514 ' HG3' ' HG2' ' X' ' 32' ' ' LYS . 1.2 mp0 60.36 175.97 0.09 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.981 1.313 . . . . 0.0 111.784 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -138.11 -173.85 3.63 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.854 171.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.505 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.492 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . 0.69 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.462 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.544 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.613 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' X' ' 20' ' ' LYS . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' X' ' 17' ' ' ASP . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.561 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.556 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.655 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.432 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.754 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.514 ' HG2' ' HG3' ' X' ' 4' ' ' GLU . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.754 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.492 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.52 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.553 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.601 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.57 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.519 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.467 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.601 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.54 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.54 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.613 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . 0.425 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.469 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.52 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.69 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.442 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.402 ' CD2' HD11 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt -83.69 110.21 18.1 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -128.81 125.71 38.34 Favored 'General case' 0 C--N 1.261 -3.273 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.058 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 80.72 -67.34 0.12 Allowed 'General case' 0 CA--C 1.499 -1.016 0 C-N-CA 124.949 1.3 . . . . 0.0 113.801 168.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 19.5 p -53.77 -67.83 0.23 Allowed 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 115.54 1.681 . . . . 0.0 115.54 -170.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 56.36 97.14 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.766 0.793 . . . . 0.0 109.678 -167.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.07 164.06 30.67 Favored Glycine 0 C--N 1.286 -2.195 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 -175.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' X' ' 85' ' ' LYS . 3.7 mptp? -92.0 -41.29 10.63 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 118.145 0.972 . . . . 0.0 112.629 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -95.24 -50.88 4.84 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.396 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 61.85 -57.98 0.12 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.087 1.755 . . . . 0.0 114.605 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.92 -95.8 0.12 Allowed Glycine 0 C--N 1.301 -1.375 0 N-CA-C 108.641 -1.783 . . . . 0.0 108.641 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -111.23 97.52 6.84 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -125.99 105.07 8.63 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -95.6 103.13 14.99 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.484 0.659 . . . . 0.0 110.822 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -93.78 125.27 8.17 Favored Glycine 0 N--CA 1.42 -2.371 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.448 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.1 m 70.25 81.15 0.17 Allowed 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.469 1.108 . . . . 0.0 110.449 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . 0.476 ' HA2' ' CZ ' ' X' ' 9' ' ' PHE . . . 71.95 174.61 22.59 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 119.698 -1.239 . . . . 0.0 114.218 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -163.66 110.82 1.15 Allowed 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.262 0.625 . . . . 0.0 110.217 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 162.48 -42.12 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.649 1.98 . . . . 0.0 105.705 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 2.4 m -46.19 -56.37 5.79 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 112.745 -2.025 . . . . 0.0 113.829 -176.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -103.81 11.48 35.7 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.156 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -81.42 87.02 6.21 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 31.6 m -111.39 -48.78 6.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 176.75 -55.04 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.299 0.375 . . . . 0.0 110.066 -176.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.18 -41.21 87.93 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.41 -2.434 0 N-CA-C 102.525 -3.139 . . . . 0.0 102.525 174.5 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 CA--C 1.501 -0.904 0 CA-C-O 121.354 0.597 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -152.29 19.63 0.65 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.506 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtt180 -130.92 -169.79 2.23 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.566 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -96.68 145.58 25.65 Favored 'General case' 0 C--N 1.279 -2.494 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.322 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.527 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 15.7 t70 -73.64 179.24 4.24 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 172.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.609 ' CZ3' HG22 ' X' ' 93' ' ' THR . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.566 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.447 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.463 ' HG3' ' CG ' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.4 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.506 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.494 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.585 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 26' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.492 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.734 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . 0.46 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.642 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.495 HG23 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.524 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . 0.418 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.637 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . 0.585 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.54 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . 0.419 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . 0.589 ' OE1' ' HB ' ' X' ' 93' ' ' THR . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.457 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.488 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.585 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.495 ' CE1' HG23 ' X' ' 34' ' ' THR 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.637 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.566 HG13 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.566 ' H ' HG13 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . 0.475 ' O ' HD13 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . 0.585 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.562 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.535 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.49 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.51 ' HB2' ' HZ2' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.566 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.463 ' CG ' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.436 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -120.03 112.01 18.61 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 8.7 t -129.09 107.45 9.6 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.866 168.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.7 t70 59.64 90.49 0.06 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.872 1.32 . . . . 0.0 114.535 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 t -139.72 -58.24 0.57 Allowed 'General case' 0 C--N 1.257 -3.439 0 N-CA-C 103.374 -2.824 . . . . 0.0 103.374 170.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 37.17 78.7 0.03 OUTLIER 'General case' 0 C--O 1.248 0.976 0 O-C-N 125.462 1.726 . . . . 0.0 114.418 170.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.34 46.32 0.05 OUTLIER Glycine 0 N--CA 1.424 -2.108 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.705 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.527 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 1.4 tmtp? -74.39 83.44 1.94 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-O 122.997 1.38 . . . . 0.0 107.687 174.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -161.14 -50.17 0.04 OUTLIER 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 103.093 -2.929 . . . . 0.0 103.093 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.88 -50.55 13.09 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 170.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.13 142.84 26.76 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -114.29 -0.92 13.72 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 117.346 0.573 . . . . 0.0 111.369 -174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.65 134.0 50.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.237 0.542 . . . . 0.0 112.191 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.92 128.78 41.97 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 174.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.22 17.87 21.47 Favored Glycine 0 C--N 1.308 -0.979 0 C-N-CA 119.535 -1.317 . . . . 0.0 115.343 -170.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 93' ' ' THR . . . . . 0.609 HG22 ' CZ3' ' X' ' 7' ' ' TRP . 72.7 p -105.35 150.32 25.32 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 117.56 0.68 . . . . 0.0 109.4 -178.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . 0.408 ' H ' ' CG2' ' X' ' 75' ' ' THR . . . -91.15 -1.98 71.76 Favored Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 117.768 -2.158 . . . . 0.0 110.576 171.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -99.65 -74.98 0.58 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.02 13.54 26.71 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -170.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 61.9 m -62.46 104.93 0.56 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.229 0.537 . . . . 0.0 111.586 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -132.0 177.22 7.72 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -117.27 -45.37 2.74 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.097 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 m -122.32 70.92 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 58.4 97.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.163 1.785 . . . . 0.0 114.84 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 69.26 2.38 3.65 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 125.298 1.439 . . . . 0.0 112.884 174.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 28.1 t70 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.154 -178.359 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -98.51 59.99 1.31 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 123.005 1.383 . . . . 0.0 109.258 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -148.74 156.93 43.04 Favored 'General case' 0 C--N 1.282 -2.362 0 CA-C-N 113.264 -1.789 . . . . 0.0 106.23 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.558 ' HG2' ' HZ2' ' X' ' 32' ' ' LYS . 3.7 mp0 -121.51 165.7 15.25 Favored 'General case' 0 N--CA 1.404 -2.75 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 144.5 34.08 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 167.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.401 ' O ' HD12 ' X' ' 79' ' ' LEU . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.554 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.64 ' CZ ' ' HA3' ' X' ' 94' ' ' GLY . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.546 ' O ' HG21 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.526 ' O ' ' HE3' ' X' ' 14' ' ' LYS . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.533 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.526 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.701 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.701 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.651 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.586 HG23 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.415 ' HZ ' ' HA ' ' X' ' 4' ' ' GLU . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' X' ' 34' ' ' THR 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . 0.457 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.487 ' HB ' HD21 ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . 0.527 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . 0.533 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.476 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.526 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.471 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.586 ' CE2' HG23 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.487 HD21 ' HB ' ' X' ' 43' ' ' ILE . 18.6 t30 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.541 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.541 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . 0.449 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.54 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . 0.484 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.54 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . 0.546 HG21 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.477 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.417 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.41 HG22 ' ND2' ' X' ' 12' ' ' ASN . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.614 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.449 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . 0.401 HD12 ' O ' ' X' ' 6' ' ' CYS . 38.0 tp -75.54 104.67 6.19 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -128.88 129.2 45.23 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.922 172.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 62.25 23.08 13.62 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.868 0.867 . . . . 0.0 113.312 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 42.3 t -128.64 -1.36 5.46 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.627 -0.671 . . . . 0.0 110.443 -177.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.312 14.5 pt-20 59.18 -30.07 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.832 2.453 . . . . 0.0 115.544 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.22 -106.17 0.84 Allowed Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 119.116 -1.516 . . . . 0.0 116.862 169.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.468 ' NZ ' ' HB2' ' X' ' 85' ' ' LYS . 3.8 ttmp? -78.73 96.4 5.56 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.818 -0.691 . . . . 0.0 112.182 -168.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -179.96 -53.68 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.083 0 C-N-CA 124.384 1.074 . . . . 0.0 108.764 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.47 150.92 41.28 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.716 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.28 136.35 14.34 Favored Glycine 0 N--CA 1.428 -1.834 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -161.33 85.73 0.66 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.45 -65.45 1.01 Allowed 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.184 -178.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.81 101.69 14.28 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -92.26 -9.58 61.76 Favored Glycine 0 CA--C 1.496 -1.098 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 2.7 m -61.34 115.25 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 124.601 1.16 . . . . 0.0 109.753 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . 0.64 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -68.83 83.67 0.21 Allowed Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.006 -1.092 . . . . 0.0 111.1 171.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.26 119.96 8.35 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -177.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.03 17.41 6.7 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.21 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -83.4 87.84 6.98 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.55 151.44 19.58 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.089 -173.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -108.0 11.96 27.37 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.846 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . 0.407 ' C ' ' H ' ' X' ' 102' ' ' GLU . 56.4 t 68.41 83.76 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.589 1.155 . . . . 0.0 111.008 177.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 72.14 -32.09 0.24 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.27 1.428 . . . . 0.0 113.143 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . 0.407 ' H ' ' C ' ' X' ' 100' ' ' VAL . 36.6 tt0 -68.71 -47.89 65.24 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.66 0.784 . . . . 0.0 111.622 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.016 -174.814 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.511 -0.526 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -167.41 99.99 0.5 Allowed 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -113.16 132.49 55.45 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.387 0.613 . . . . 0.0 110.019 -177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' X' ' 89' ' ' ASN . 22.0 mt-10 -127.49 157.99 38.59 Favored 'General case' 0 C--N 1.275 -2.668 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.633 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 -75.6 -179.11 4.47 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.734 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.633 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.541 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.557 ' HZ3' ' HB2' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.592 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.547 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.635 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.525 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.552 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.552 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.549 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.489 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . 0.443 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.443 ' HG2' ' HB3' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.635 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.649 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.544 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.544 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . 0.454 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . 0.454 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . 0.547 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.57 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.581 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.557 ' HB2' ' HZ3' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.541 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.623 ' OD1' ' HE3' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.445 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . 0.734 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp -60.86 121.27 11.92 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 89.9 m -128.54 136.77 51.22 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.631 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 t70 81.4 -71.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.148 1.379 . . . . 0.0 114.073 170.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . 0.426 ' O ' HD12 ' X' ' 79' ' ' LEU . 0.6 OUTLIER -79.8 75.21 6.5 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . 0.437 ' HA ' HD22 ' X' ' 79' ' ' LEU . 35.6 tt0 -64.48 -32.24 73.79 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.865 175.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -110.19 135.05 12.59 Favored Glycine 0 N--CA 1.428 -1.897 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.75 84.26 2.09 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 118.216 1.008 . . . . 0.0 113.078 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -80.16 -48.61 12.88 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.1 107.26 11.98 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 174.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.82 160.42 9.87 Favored Glycine 0 N--CA 1.423 -2.231 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' X' ' 4' ' ' GLU . 6.9 p30 -176.44 146.4 0.62 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -166.89 92.18 0.43 Allowed 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.417 175.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.67 99.96 12.46 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 174.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.81 9.33 Favored Glycine 0 N--CA 1.437 -1.268 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.246 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.9 m -48.12 118.25 2.3 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 125.08 1.352 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.14 48.86 2.49 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.952 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -105.44 158.26 16.78 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 124.577 1.151 . . . . 0.0 108.069 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -75.75 78.48 2.7 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.241 0.543 . . . . 0.0 112.117 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 97' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' X' ' 103' ' ' ASP . 17.0 p -107.04 121.3 44.21 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 174.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.23 -29.75 26.25 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 72.43 12.45 5.61 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.103 1.361 . . . . 0.0 112.751 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 50.1 t -72.91 -56.38 9.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.82 42.23 1.65 Allowed 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . 0.315 1.3 pm0 42.53 57.56 3.41 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.503 -175.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' X' ' 97' ' ' SER . 34.3 t70 . . . . . 0 CA--C 1.483 -1.604 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 -177.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.496 -1.129 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -110.67 61.23 0.61 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . 0.43 ' HD3' ' O ' ' X' ' 85' ' ' LYS . 70.6 ttt180 -163.55 124.84 2.36 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 -172.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . 0.468 ' CG ' ' HG2' ' X' ' 32' ' ' LYS . 1.0 OUTLIER -54.21 133.11 44.44 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.161 0.913 . . . . 0.0 113.052 -173.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 -64.1 164.07 11.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.147 -1.388 . . . . 0.0 110.584 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . 0.473 ' HA ' ' ND2' ' X' ' 89' ' ' ASN . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.615 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.446 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . 0.563 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.463 ' N ' HD21 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.636 ' NZ ' ' HB2' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . 0.448 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.439 ' HG3' HD22 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.452 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.518 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.572 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.643 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.615 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.809 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . 0.544 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.508 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.592 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . 0.412 ' HB3' ' HG3' ' X' ' 52' ' ' GLU . 38.5 m-80 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.412 ' HG3' ' HB3' ' X' ' 50' ' ' ASN . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.572 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.809 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.592 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 13.8 t30 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.566 HG11 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.566 ' H ' HG11 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . 0.423 ' HA3' ' ND2' ' X' ' 56' ' ' ASN . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . 0.439 HD22 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . 0.491 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.549 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.466 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . 0.443 ' ND2' ' HD1' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.446 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.563 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . 0.495 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.6 109.11 13.67 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 80' ' ' THR . . . . . 0.494 ' HB ' ' CE2' ' X' ' 78' ' ' TYR . 14.4 t -127.71 121.73 31.09 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.367 172.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 37.0 t70 52.58 73.28 0.35 Allowed 'General case' 0 C--O 1.244 0.803 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 10.8 t -165.67 35.08 0.05 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -72.62 136.26 45.68 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.332 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.04 -33.61 3.47 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.43 ' O ' ' HD3' ' X' ' 3' ' ' ARG . 40.4 mmtt 63.68 34.98 11.79 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.772 1.629 . . . . 0.0 110.288 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.38 0.97 43.85 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.002 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -100.14 141.08 33.45 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.79 56.44 4.86 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.874 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . 0.473 ' ND2' ' HA ' ' X' ' 6' ' ' CYS . 7.0 t30 -81.08 108.09 14.45 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.33 -46.04 21.08 Favored 'General case' 0 C--N 1.293 -1.884 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.868 -176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.51 -84.5 0.66 Allowed 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.564 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.42 32.14 48.44 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 93' ' ' THR . . . . . 0.444 ' HA ' ' CD1' ' X' ' 9' ' ' PHE . 3.9 t -150.12 145.87 26.58 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 114.955 -0.623 . . . . 0.0 109.653 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 69.59 -92.3 0.34 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.102 -177.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 36.5 t70 56.07 -96.33 0.06 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.98 1.312 . . . . 0.0 112.692 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 53.49 -95.25 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.171 0.988 . . . . 0.0 111.912 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.7 m -170.13 173.88 5.68 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 103.833 -2.655 . . . . 0.0 103.833 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -81.78 81.8 7.68 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 175.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.9 106.63 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 m -122.75 106.82 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.33 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 75.62 -43.33 0.49 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.494 1.518 . . . . 0.0 112.632 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -136.55 -45.77 0.61 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 CA--C 1.499 -1.017 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -137.27 99.62 4.03 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -166.0 176.56 7.67 Favored 'General case' 0 CA--C 1.487 -1.48 0 C-N-CA 126.287 1.835 . . . . 0.0 106.1 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.32 128.78 52.65 Favored 'General case' 0 CA--C 1.472 -2.034 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 166.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 5' ' ' ASP . . . . . 0.533 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 4.0 t70 -86.89 178.57 6.93 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.6 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 7' ' ' TRP . . . . . 0.402 ' CZ3' HG23 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 9' ' ' PHE . . . . . 0.717 ' CE1' ' HA3' ' X' ' 94' ' ' GLY . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 11' ' ' ALA . . . . . 0.465 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 12' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' X' ' 71' ' ' ASP . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 13' ' ' ARG . . . . . 0.638 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 14' ' ' LYS . . . . . 0.638 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 20' ' ' LYS . . . . . 0.447 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 21' ' ' SER . . . . . 0.402 ' O ' HG23 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.558 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 23' ' ' LYS . . . . . 0.529 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 24' ' ' LYS . . . . . 0.452 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 26' ' ' SER . . . . . 0.422 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 27' ' ' ASP . . . . . 0.584 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 28' ' ' LEU . . . . . 0.681 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 30' ' ' GLU . . . . . 0.694 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 32' ' ' LYS . . . . . 0.681 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 33' ' ' LYS . . . . . 0.694 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 34' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 35' ' ' CYS . . . . . 0.557 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 37' ' ' LYS . . . . . 0.568 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 41' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 43' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 44' ' ' VAL . . . . . 0.402 HG23 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.627 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 52' ' ' GLU . . . . . 0.422 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 53' ' ' CYS . . . . . 0.447 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 54' ' ' TYR . . . . . 0.452 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 55' ' ' TYR . . . . . 0.529 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' O ' ' X' ' 43' ' ' ILE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 57' ' ' VAL . . . . . 0.402 HG23 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 58' ' ' VAL . . . . . 0.532 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 59' ' ' ASP . . . . . 0.532 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 67' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 68' ' ' PHE . . . . . 0.476 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 71' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 73' ' ' ASN . . . . . 0.401 HD21 ' N ' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 74' ' ' PHE . . . . . 0.627 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 75' ' ' THR . . . . . 0.48 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 76' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 77' ' ' ASN . . . . . 0.4 ' OD1' ' HE3' ' X' ' 7' ' ' TRP . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp -87.57 101.86 14.04 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.2 t -126.83 126.57 43.57 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.128 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 p30 54.05 -20.84 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 119.094 2.998 . . . . 0.0 119.094 169.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 25.6 t -79.11 -2.19 39.46 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 118.659 0.663 . . . . 0.0 110.687 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -40.83 119.49 1.14 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.736 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 123.09 38.54 0.56 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 85' ' ' LYS . . . . . 0.533 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 0.3 OUTLIER -73.72 121.85 21.44 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -157.52 173.02 17.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 68.22 18.92 9.21 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.573 1.149 . . . . 0.0 110.394 -176.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 88' ' ' GLY . . . . . 0.46 ' O ' ' HE3' ' X' ' 85' ' ' LYS . . . -168.9 164.4 38.05 Favored Glycine 0 N--CA 1.413 -2.851 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -168.38 -179.01 3.78 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 117.031 0.415 . . . . 0.0 109.93 -176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . 71.01 26.79 3.47 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 125.514 1.525 . . . . 0.0 113.162 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -145.87 118.32 8.5 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.658 -0.817 . . . . 0.0 112.84 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.98 66.06 0.18 Allowed Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.636 177.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 23.3 p -160.98 173.02 15.87 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 105.062 -2.199 . . . . 0.0 105.062 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 94' ' ' GLY . . . . . 0.717 ' HA3' ' CE1' ' X' ' 9' ' ' PHE . . . -88.84 13.98 61.46 Favored Glycine 0 N--CA 1.427 -1.918 0 C-N-CA 117.549 -2.262 . . . . 0.0 112.409 173.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -104.91 -40.51 5.91 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -80.42 74.04 7.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.822 0.82 . . . . 0.0 109.327 173.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m -147.64 26.17 1.04 Allowed 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.07 154.51 31.3 Favored 'General case' 0 C--O 1.253 1.251 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.357 -173.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -75.21 68.86 2.01 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.082 0.944 . . . . 0.0 110.752 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 100' ' ' VAL . . . . . 0.489 HG22 ' H ' ' X' ' 101' ' ' ASP . 1.6 m -130.01 -80.69 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.283 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 101' ' ' ASP . . . . . 0.489 ' H ' HG22 ' X' ' 100' ' ' VAL . 6.6 m-20 -116.83 7.15 13.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.334 0.588 . . . . 0.0 109.807 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -103.29 -18.74 14.74 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.682 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.428 -1.55 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 177.408 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.562 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.407 -2.619 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 6' ' ' CYS . . . . . 0.621 ' O ' HD12 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.451 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.495 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.672 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 16' ' ' THR . . . . . 0.406 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.455 ' HD1' ' HA ' ' X' ' 56' ' ' ASN . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.56 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.595 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.517 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.574 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.574 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.595 HG21 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.486 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 40' ' ' TYR . . . . . 0.408 ' HB3' ' CE1' ' X' ' 42' ' ' TYR . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.56 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.469 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.672 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 46' ' ' GLU . . . . . 0.693 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 48' ' ' THR . . . . . 0.513 ' OG1' HG23 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.452 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.595 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 57' ' ' VAL . . . . . 0.486 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.702 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.702 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.489 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.547 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.693 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.495 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 79' ' ' LEU . . . . . 0.621 HD12 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.539 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.421 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 11' ' ' ALA . . . . . 0.458 ' HB3' ' HD2' ' X' ' 13' ' ' ARG . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 12' ' ' ASN . . . . . 0.44 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB3' ' X' ' 11' ' ' ALA . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.721 ' HA ' ' HE3' ' X' ' 14' ' ' LYS . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.469 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.505 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.604 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 26' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.559 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.649 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.539 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.523 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 46' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.457 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.56 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.604 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.64 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.7 t-20 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.657 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.657 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.456 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 63' ' ' LEU . . . . . 0.456 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.666 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.52 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.587 ' HB2' ' HZ1' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.489 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 17.8 p30 -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.48 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.252 1.235 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.734 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.712 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.563 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.511 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.412 ' HB3' ' CG2' ' X' ' 58' ' ' VAL . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.511 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.582 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.675 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.517 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.563 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 39' ' ' GLU . . . . . 0.563 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.427 ' HA ' ' HB3' ' X' ' 79' ' ' LEU 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.49 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.414 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.563 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 46' ' ' GLU . . . . . 0.417 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 51' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 53' ' ' CYS . . . . . 0.417 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.49 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.775 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.775 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.421 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.533 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 66' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.533 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.461 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.485 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.402 ' HG2' ' NE2' ' X' ' 65' ' ' GLN . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.712 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 79' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' X' ' 42' ' ' TYR . 36.5 tp . . . . . 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.437 ' HB2' ' CD1' ' X' ' 7' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.658 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 15' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.684 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.488 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.614 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 26' ' ' SER . . . . . 0.451 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.704 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.704 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.711 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.48 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.491 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' X' X ' 39' ' ' GLU . . . . . 0.491 ' H ' HG22 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 40' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' X' ' 59' ' ' ASP . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.711 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.587 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.403 HG21 ' CZ2' ' X' ' 7' ' ' TRP . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.658 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' X' ' 52' ' ' GLU . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.438 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' X' ' 47' ' ' ASP . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 53' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.544 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.587 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.741 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.741 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 63' ' ' LEU . . . . . 0.457 HD12 HG21 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.458 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.623 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 69' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' X' ' 14' ' ' LYS . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.573 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 72' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.581 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' X' X ' 6' ' ' CYS . . . . . 0.509 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.531 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 11' ' ' ALA . . . . . 0.706 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 12' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' X' ' 13' ' ' ARG . 3.6 m-20 -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.589 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.707 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.595 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.572 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.681 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.503 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.717 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.531 ' HE3' ' CH2' ' X' ' 7' ' ' TRP . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.583 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.548 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.451 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 39' ' ' GLU . . . . . 0.451 ' H ' HG22 ' X' ' 38' ' ' THR . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.639 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.564 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.572 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.401 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 51' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.572 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.572 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.639 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.745 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.745 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.707 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 72' ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 73' ' ' ASN . . . . . 0.423 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.499 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.575 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 21.4 p30 -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.452 ' CD2' HD12 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 79' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt . . . . . 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 15.7 t70 . . . . . 0 C--O 1.239 0.513 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.539 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.644 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.486 ' HG3' ' CG ' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.691 ' HB3' ' HB3' ' X' ' 71' ' ' ASP . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.441 ' HB3' HG21 ' X' ' 58' ' ' VAL . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.553 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.502 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.601 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 26' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.66 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.772 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 29' ' ' ASP . . . . . 0.421 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' X' ' 27' ' ' ASP 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.772 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 40' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.666 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.604 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.464 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.4 ' HB3' ' CD1' ' X' ' 74' ' ' PHE . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.46 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.496 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.601 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.502 ' CE1' ' HB3' ' X' ' 23' ' ' LYS 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.666 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.715 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.715 ' H ' HG12 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.507 ' O ' HD12 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 61' ' ' GLU . . . . . 0.604 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 63' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.411 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.574 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.643 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.691 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 72' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' X' ' 72' ' ' GLU . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.536 ' HD2' ' HZ1' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.644 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.505 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.645 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 12' ' ' ASN . . . . . 0.547 ' O ' HG23 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.586 ' HG2' ' HB3' ' X' ' 68' ' ' PHE . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' X' ' 71' ' ' ASP . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.465 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.589 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.666 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.735 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.666 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.591 HG21 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.423 HG22 ' H ' ' X' ' 39' ' ' GLU . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 39' ' ' GLU . . . . . 0.423 ' H ' HG22 ' X' ' 38' ' ' THR . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.459 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.541 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 45' ' ' PHE . . . . . 0.537 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 51' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' X' ' 51' ' ' LYS . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 53' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.477 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.591 ' CE2' HG21 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.597 ' ND2' ' H ' ' X' ' 58' ' ' VAL . 3.1 t-20 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.735 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.735 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.506 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 66' ' ' GLU . . . . . 0.493 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.495 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.586 ' HB3' ' HG2' ' X' ' 13' ' ' ARG . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.547 HG23 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.414 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.645 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.511 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 38.0 tp . . . . . 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.718 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 6' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.718 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.682 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.405 ' HD3' ' HB2' ' X' ' 68' ' ' PHE . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.52 ' HZ1' ' HD1' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.568 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.638 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.649 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.589 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.599 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.593 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.676 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' X' ' 78' ' ' TYR . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.49 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 50' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' CB ' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.638 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.568 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.676 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.728 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.728 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.521 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 63' ' ' LEU . . . . . 0.521 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.54 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 65' ' ' GLN . . . . . 0.592 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.576 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.52 ' HD1' ' HZ1' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.571 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.682 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.588 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 79' ' ' LEU . . . . . 0.745 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.602 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.64 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 10' ' ' TYR . . . . . 0.576 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 11' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.647 ' NZ ' ' HB2' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 17' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 19' ' ' ASP . . . . . 0.458 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.484 ' HG3' HD21 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.448 ' HB2' HG21 ' X' ' 58' ' ' VAL . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.484 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.584 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.656 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.656 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.64 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.533 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.414 ' HA ' ' HE3' ' X' ' 37' ' ' LYS . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 38' ' ' THR . . . . . 0.437 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 39' ' ' GLU . . . . . 0.437 ' H ' HG22 ' X' ' 38' ' ' THR . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 40' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' X' ' 58' ' ' VAL . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.675 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 42' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.609 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 46' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.584 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.704 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 3.6 t-20 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.74 HG12 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.74 ' H ' HG12 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 60' ' ' GLY . . . . . 0.455 ' H ' ' HE1' ' X' ' 42' ' ' TYR . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 63' ' ' LEU . . . . . 0.484 HD21 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 64' ' ' ASP . . . . . 0.523 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.625 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 70' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.526 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.554 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.466 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.576 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 78' ' ' TYR . . . . . 0.433 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 79' ' ' LEU . . . . . 0.477 ' HB3' ' HB2' ' X' ' 42' ' ' TYR . 15.5 tp . . . . . 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 5' ' ' ASP . . . . . 0.419 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 4.0 t70 . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 7' ' ' TRP . . . . . 0.41 ' CZ3' HG21 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 9' ' ' PHE . . . . . 0.504 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 11' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 12' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' X' ' 72' ' ' GLU . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 13' ' ' ARG . . . . . 0.66 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 14' ' ' LYS . . . . . 0.66 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 21' ' ' SER . . . . . 0.406 ' O ' HG22 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.6 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 23' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 27' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 28' ' ' LEU . . . . . 0.668 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 30' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 32' ' ' LYS . . . . . 0.668 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 33' ' ' LYS . . . . . 0.704 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 34' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 35' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 36' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 37' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 43' ' ' ILE . . . . . 0.561 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 44' ' ' VAL . . . . . 0.41 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.63 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 53' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 54' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 55' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 56' ' ' ASN . . . . . 0.6 ' HA ' ' CD1' ' X' ' 22' ' ' PHE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 58' ' ' VAL . . . . . 0.676 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 59' ' ' ASP . . . . . 0.676 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 67' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 68' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 71' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 72' ' ' GLU . . . . . 0.469 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 74' ' ' PHE . . . . . 0.63 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 75' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 76' ' ' GLU . . . . . 0.479 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 77' ' ' ASN . . . . . 0.433 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -82.46 6.72 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -110.44 97.29 6.77 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.556 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -95.73 167.97 10.95 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.317 1.056 . . . . 0.0 111.194 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.562 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER -75.98 136.43 40.01 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-N 112.662 -2.063 . . . . 0.0 105.677 165.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 6' ' ' CYS . . . . . 0.621 ' O ' HD12 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.451 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.495 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.672 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 16' ' ' THR . . . . . 0.406 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.455 ' HD1' ' HA ' ' X' ' 56' ' ' ASN . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.56 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.595 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.517 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.574 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.574 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.595 HG21 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.486 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 40' ' ' TYR . . . . . 0.408 ' HB3' ' CE1' ' X' ' 42' ' ' TYR . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.56 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.469 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.672 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 46' ' ' GLU . . . . . 0.693 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 48' ' ' THR . . . . . 0.513 ' OG1' HG23 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.452 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.595 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 57' ' ' VAL . . . . . 0.486 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.702 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.702 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.517 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.489 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.547 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.693 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.495 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 79' ' ' LEU . . . . . 0.621 HD12 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp -57.71 111.81 1.26 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 34.3 m -125.53 107.28 10.46 Favored 'General case' 0 N--CA 1.42 -1.942 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.527 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 62.6 64.28 0.93 Allowed 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 82' ' ' CYS . . . . . 0.427 ' HB2' HD11 ' X' ' 79' ' ' LEU . 84.8 m -135.31 -70.71 0.48 Allowed 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 175.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.06 20.99 0.28 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.223 1.809 . . . . 0.0 114.258 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.65 177.81 36.01 Favored Glycine 0 N--CA 1.424 -2.157 0 N-CA-C 107.695 -2.162 . . . . 0.0 107.695 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.3 -85.03 0.54 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 117.993 0.897 . . . . 0.0 110.788 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 32.9 t70 59.58 -81.17 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.08 1.352 . . . . 0.0 110.924 -174.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.58 95.68 4.53 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 88' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' X' ' 4' ' ' GLU . . . -116.2 107.82 1.72 Allowed Glycine 0 N--CA 1.425 -2.087 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.375 -172.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -159.86 124.49 3.89 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -146.35 97.85 2.99 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.365 0.603 . . . . 0.0 111.717 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.0 82.69 4.23 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.582 0.705 . . . . 0.0 110.038 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -138.7 4.2 2.98 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.078 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 93' ' ' THR . . . . . 0.485 ' HB ' ' CD ' ' X' ' 46' ' ' GLU . 16.6 p -70.32 114.77 8.78 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 122.538 0.335 . . . . 0.0 110.213 -176.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' CG2' ' X' ' 75' ' ' THR . . . 62.35 22.08 62.91 Favored Glycine 0 C--N 1.357 1.74 0 C-N-CA 119.97 -1.11 . . . . 0.0 114.128 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -88.44 -33.92 17.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 117.536 0.668 . . . . 0.0 112.05 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.39 149.2 24.62 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m 76.97 91.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.092 1.757 . . . . 0.0 112.213 -178.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -94.27 122.23 36.61 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 99' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' X' ' 103' ' ' ASP . 37.5 tt0 -109.4 -66.28 1.07 Allowed 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.44 176.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 44.6 t -88.79 -66.42 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.174 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -113.55 -85.8 0.58 Allowed 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -110.73 -1.49 16.66 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 103' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' X' ' 99' ' ' GLU . 3.7 p30 . . . . . 0 N--CA 1.422 -1.863 0 N-CA-C 102.738 -3.06 . . . . 0.0 102.738 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' X' X ' 2' ' ' GLU . . . . . 0.434 ' OE1' ' HE2' ' X' ' 33' ' ' LYS . 26.6 mt-10 -100.3 -41.55 7.02 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -173.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 71.5 122.64 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.006 1.322 . . . . 0.0 112.15 175.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -58.03 113.63 1.98 Allowed 'General case' 0 CA--C 1.49 -1.349 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.539 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 -64.8 -173.73 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 124.812 1.32 . . . . 0.0 112.54 -173.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.421 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 11' ' ' ALA . . . . . 0.458 ' HB3' ' HD2' ' X' ' 13' ' ' ARG . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 12' ' ' ASN . . . . . 0.44 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB3' ' X' ' 11' ' ' ALA . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.721 ' HA ' ' HE3' ' X' ' 14' ' ' LYS . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.469 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.505 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.604 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 26' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.559 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.649 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.539 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.523 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 46' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.457 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.56 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.604 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.64 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.7 t-20 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.657 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.657 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.456 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 63' ' ' LEU . . . . . 0.456 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.666 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.52 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.587 ' HB2' ' HZ1' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.489 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.48 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp -81.48 107.83 14.57 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -128.76 147.62 50.79 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.728 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 80.11 -55.69 0.37 Allowed 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 165.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 69.1 m -62.01 -74.94 0.08 Allowed 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.453 1.1 pp20? 38.59 61.11 1.24 Allowed 'General case' 0 C--N 1.348 0.533 0 CA-C-O 123.807 1.765 . . . . 0.0 111.215 -162.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.12 92.13 0.14 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 -168.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -45.69 107.28 0.1 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.517 1.527 . . . . 0.0 114.475 -171.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -133.45 -53.31 0.89 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.207 0.527 . . . . 0.0 110.573 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.56 32.25 1.1 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.313 0.578 . . . . 0.0 110.38 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -73.15 -14.14 79.15 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.778 -176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -85.12 -12.47 52.8 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.741 0.305 . . . . 0.0 110.766 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -84.52 94.38 8.55 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 65.18 -78.87 0.03 OUTLIER 'General case' 0 C--O 1.239 0.548 0 C-N-CA 125.517 1.527 . . . . 0.0 112.519 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.81 -110.08 3.02 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 121.316 -0.469 . . . . 0.0 112.845 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.3 p -103.96 113.91 27.78 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -173.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 53.32 51.87 44.46 Favored Glycine 0 N--CA 1.475 1.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 113.941 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -123.93 96.13 4.83 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 120.046 -0.661 . . . . 0.0 111.437 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -128.67 133.49 48.24 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 27.0 m -81.42 -49.43 10.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 t70 176.32 -169.01 0.05 Allowed 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -137.31 91.55 2.62 Favored 'General case' 0 C--N 1.289 -2.046 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 176.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 2.1 t -127.58 14.99 3.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.1 t70 66.29 78.35 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.211 1.005 . . . . 0.0 108.792 -170.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -162.96 -49.12 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 113.773 -1.558 . . . . 0.0 107.045 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--N 1.311 -1.104 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.442 177.132 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.896 0.855 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' X' X ' 2' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 2' ' ' GLU . 1.2 pm0 -73.81 25.15 0.07 Allowed 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 127.183 2.193 . . . . 0.0 113.692 -174.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -93.68 -65.1 1.01 Allowed 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.607 ' HG2' ' HG2' ' X' ' 32' ' ' LYS . 24.9 mt-10 -133.79 147.96 51.31 Favored 'General case' 0 N--CA 1.426 -1.667 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -92.64 -176.24 4.21 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.734 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.712 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.563 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.511 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.412 ' HB3' ' CG2' ' X' ' 58' ' ' VAL . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.511 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.582 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.675 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.517 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.563 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 39' ' ' GLU . . . . . 0.563 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.427 ' HA ' ' HB3' ' X' ' 79' ' ' LEU 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.49 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.414 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.563 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 46' ' ' GLU . . . . . 0.417 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 53' ' ' CYS . . . . . 0.417 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.49 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.775 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.775 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.421 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.533 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 66' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.533 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.461 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.485 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.402 ' HG2' ' NE2' ' X' ' 65' ' ' GLN . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.712 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 79' ' ' LEU . . . . . 0.473 HD11 ' H ' ' X' ' 83' ' ' GLU . 36.5 tp -84.06 84.4 7.61 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 80' ' ' THR . . . . . 0.445 ' O ' ' HB2' ' X' ' 81' ' ' ASP . 8.8 t -129.88 104.79 7.58 Favored 'General case' 0 C--N 1.244 -3.984 0 CA-C-N 113.489 -1.687 . . . . 0.0 106.648 167.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 81' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' X' ' 80' ' ' THR . 39.0 t70 167.69 -69.86 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.883 0.873 . . . . 0.0 109.937 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 82' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' X' ' 84' ' ' GLY . 97.8 m -87.0 -61.53 1.71 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.694 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 83' ' ' GLU . . . . . 0.473 ' H ' HD11 ' X' ' 79' ' ' LEU . 1.4 mp0 53.96 55.63 8.11 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 122.859 1.314 . . . . 0.0 108.086 -169.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 84' ' ' GLY . . . . . 0.566 ' O ' ' HB3' ' X' ' 82' ' ' CYS . . . 131.66 100.39 0.81 Allowed Glycine 0 N--CA 1.409 -3.14 0 N-CA-C 105.692 -2.963 . . . . 0.0 105.692 -169.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' X' ' 4' ' ' GLU . 14.4 tmtt? -50.06 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.513 1.125 . . . . 0.0 111.388 -173.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -120.18 -49.6 2.28 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.3 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.5 -31.42 72.49 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.397 0.618 . . . . 0.0 111.075 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 106.21 -32.4 7.38 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.836 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -65.31 140.65 58.71 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.034 0.445 . . . . 0.0 110.632 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.36 133.23 45.08 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -45.99 55.2 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.308 0.575 . . . . 0.0 109.725 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.44 -63.02 4.38 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 -175.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.1 t 171.33 158.2 0.08 Allowed 'General case' 0 C--O 1.254 1.295 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.546 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -76.36 175.88 52.49 Favored Glycine 0 C--O 1.238 0.393 0 C-N-CA 118.59 -1.766 . . . . 0.0 112.516 176.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -156.61 -60.88 0.1 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 53.9 86.17 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.623 1.569 . . . . 0.0 113.776 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.8 m -84.12 153.34 23.79 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -80.08 89.47 5.39 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.035 0.445 . . . . 0.0 110.387 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.2 120.86 43.79 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.955 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . 0.331 11.2 p 52.09 -72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 127.291 2.236 . . . . 0.0 116.872 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -81.13 -18.17 47.36 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 121.193 -0.942 . . . . 0.0 110.817 -174.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -82.28 -31.3 30.13 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.493 -1.237 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.097 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.96 4.42 39.98 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.071 0.939 . . . . 0.0 108.504 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -112.21 122.22 47.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.568 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.587 ' O ' ' HA3' ' X' ' 88' ' ' GLY . 34.4 mt-10 -102.95 160.39 14.66 Favored 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.513 ' OD2' ' HG3' ' X' ' 85' ' ' LYS . 0.9 OUTLIER -64.9 -174.62 0.15 Allowed 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 171.314 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 6' ' ' CYS . . . . . 0.751 ' SG ' ' HG2' ' X' ' 83' ' ' GLU 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.658 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 15' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.684 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.488 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.614 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 26' ' ' SER . . . . . 0.451 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.704 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.704 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' HG2' ' X' ' 4' ' ' GLU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.711 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.48 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.491 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' X' X ' 39' ' ' GLU . . . . . 0.491 ' H ' HG22 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 40' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' X' ' 59' ' ' ASP . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.711 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.587 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.403 HG21 ' CZ2' ' X' ' 7' ' ' TRP . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.658 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' X' ' 52' ' ' GLU . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.438 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' X' ' 47' ' ' ASP . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 53' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.544 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.587 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.741 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.741 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 63' ' ' LEU . . . . . 0.457 HD12 HG21 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.458 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.623 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 69' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' X' ' 14' ' ' LYS . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.573 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 72' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.581 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp -85.02 116.91 23.68 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -125.98 105.48 8.94 Favored 'General case' 0 N--CA 1.428 -1.563 0 C-N-CA 119.043 -1.063 . . . . 0.0 112.09 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 35.72 35.0 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 127.916 2.487 . . . . 0.0 115.599 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.4 p -86.63 -38.09 17.42 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.139 -0.975 . . . . 0.0 110.495 176.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 83' ' ' GLU . . . . . 0.751 ' HG2' ' SG ' ' X' ' 6' ' ' CYS . 12.7 pt-20 -172.12 -178.71 2.16 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 84' ' ' GLY . . . . . 0.406 ' C ' ' HD2' ' X' ' 85' ' ' LYS . . . -87.92 -96.53 0.94 Allowed Glycine 0 N--CA 1.423 -2.216 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.513 ' HG3' ' OD2' ' X' ' 5' ' ' ASP . 3.3 mptp? -138.29 77.56 1.63 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -106.51 -64.37 1.18 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.145 0.498 . . . . 0.0 110.053 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -133.42 -33.08 1.12 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 88' ' ' GLY . . . . . 0.587 ' HA3' ' O ' ' X' ' 4' ' ' GLU . . . 65.09 -131.18 36.04 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -177.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -161.99 173.49 14.36 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -98.81 138.73 35.53 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 66.46 86.1 0.14 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.849 1.343 . . . . 0.0 112.021 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.57 -32.45 2.71 Favored Glycine 0 C--N 1.307 -1.06 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.075 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 9.4 t -110.56 142.21 42.68 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 122.502 -0.411 . . . . 0.0 110.98 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.18 -61.23 1.42 Allowed Glycine 0 C--N 1.338 0.663 0 N-CA-C 114.553 0.581 . . . . 0.0 114.553 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.0 105.14 5.87 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.459 0.704 . . . . 0.0 109.699 -174.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.59 105.58 0.81 Allowed 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 14.9 m -134.2 141.88 47.2 Favored 'General case' 0 N--CA 1.425 -1.689 0 O-C-N 123.696 0.622 . . . . 0.0 110.334 -174.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -89.45 158.76 17.59 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -103.11 -51.27 3.29 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.92 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 m -129.53 73.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 63.64 -72.43 0.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.536 1.535 . . . . 0.0 114.231 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.01 -57.81 4.95 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.268 2.07 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 178.664 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.224 0.059 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -130.65 -10.39 3.99 Favored 'General case' 0 CA--C 1.511 -0.552 0 O-C-N 122.225 -0.297 . . . . 0.0 111.456 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 72.25 152.06 0.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.726 0.811 . . . . 0.0 112.781 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.704 ' HG3' ' HG2' ' X' ' 32' ' ' LYS . 1.2 mp0 60.36 175.97 0.09 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.981 1.313 . . . . 0.0 111.784 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -138.11 -173.85 3.63 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.854 171.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 6' ' ' CYS . . . . . 0.509 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.531 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 11' ' ' ALA . . . . . 0.706 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 12' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' X' ' 13' ' ' ARG . 3.6 m-20 -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.589 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.707 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.595 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.572 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.681 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.503 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.717 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.704 ' HG2' ' HG3' ' X' ' 4' ' ' GLU . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.583 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.548 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.451 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 39' ' ' GLU . . . . . 0.451 ' H ' HG22 ' X' ' 38' ' ' THR . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.639 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.564 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.454 ' HB ' HD21 ' X' ' 77' ' ' ASN . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.572 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.401 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.572 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.572 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.639 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.745 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.745 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.707 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 72' ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 73' ' ' ASN . . . . . 0.423 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.499 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.575 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.452 ' CD2' HD12 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 79' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt -83.69 110.21 18.1 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -128.81 125.71 38.34 Favored 'General case' 0 C--N 1.261 -3.273 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.058 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 80.72 -67.34 0.12 Allowed 'General case' 0 CA--C 1.499 -1.016 0 C-N-CA 124.949 1.3 . . . . 0.0 113.801 168.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 19.5 p -53.77 -67.83 0.23 Allowed 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 115.54 1.681 . . . . 0.0 115.54 -170.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 56.36 97.14 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.766 0.793 . . . . 0.0 109.678 -167.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.07 164.06 30.67 Favored Glycine 0 C--N 1.286 -2.195 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 -175.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.509 ' HD2' ' N ' ' X' ' 85' ' ' LYS . 3.7 mptp? -92.0 -41.29 10.63 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 118.145 0.972 . . . . 0.0 112.629 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -95.24 -50.88 4.84 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.396 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 61.85 -57.98 0.12 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.087 1.755 . . . . 0.0 114.605 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.92 -95.8 0.12 Allowed Glycine 0 C--N 1.301 -1.375 0 N-CA-C 108.641 -1.783 . . . . 0.0 108.641 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -111.23 97.52 6.84 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -125.99 105.07 8.63 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 91' ' ' ALA . . . . . 0.472 ' HB3' ' HB2' ' X' ' 9' ' ' PHE . . . -95.6 103.13 14.99 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.484 0.659 . . . . 0.0 110.822 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -93.78 125.27 8.17 Favored Glycine 0 N--CA 1.42 -2.371 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.448 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.1 m 70.25 81.15 0.17 Allowed 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.469 1.108 . . . . 0.0 110.449 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.478 ' HA2' ' CZ ' ' X' ' 9' ' ' PHE . . . 71.95 174.61 22.59 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 119.698 -1.239 . . . . 0.0 114.218 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -163.66 110.82 1.15 Allowed 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.262 0.625 . . . . 0.0 110.217 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 162.48 -42.12 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.649 1.98 . . . . 0.0 105.705 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 2.4 m -46.19 -56.37 5.79 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 112.745 -2.025 . . . . 0.0 113.829 -176.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -103.81 11.48 35.7 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.156 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -81.42 87.02 6.21 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 31.6 m -111.39 -48.78 6.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 176.75 -55.04 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.299 0.375 . . . . 0.0 110.066 -176.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.18 -41.21 87.93 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.41 -2.434 0 N-CA-C 102.525 -3.139 . . . . 0.0 102.525 174.5 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 CA--C 1.501 -0.904 0 CA-C-O 121.354 0.597 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -152.29 19.63 0.65 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.506 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtt180 -130.92 -169.79 2.23 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -96.68 145.58 25.65 Favored 'General case' 0 C--N 1.279 -2.494 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.322 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.515 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 15.7 t70 -73.64 179.24 4.24 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 172.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.621 ' CZ3' HG22 ' X' ' 93' ' ' THR . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.644 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.486 ' HG3' ' CG ' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.691 ' HB3' ' HB3' ' X' ' 71' ' ' ASP . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.441 ' HB3' HG21 ' X' ' 58' ' ' VAL . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.553 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.502 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.601 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 26' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.66 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.772 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 29' ' ' ASP . . . . . 0.421 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' X' ' 27' ' ' ASP 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.772 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 40' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.666 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.604 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.464 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.4 ' HB3' ' CD1' ' X' ' 74' ' ' PHE . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 46' ' ' GLU . . . . . 0.609 ' OE1' ' HB ' ' X' ' 93' ' ' THR . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.46 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.496 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.601 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.502 ' CE1' ' HB3' ' X' ' 23' ' ' LYS 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.666 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.715 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.715 ' H ' HG12 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.507 ' O ' HD12 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 61' ' ' GLU . . . . . 0.604 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 63' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.411 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.574 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.643 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.691 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 72' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' X' ' 72' ' ' GLU . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.536 ' HD2' ' HZ1' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.644 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.505 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -120.03 112.01 18.61 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 8.7 t -129.09 107.45 9.6 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.866 168.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.7 t70 59.64 90.49 0.06 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.872 1.32 . . . . 0.0 114.535 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 t -139.72 -58.24 0.57 Allowed 'General case' 0 C--N 1.257 -3.439 0 N-CA-C 103.374 -2.824 . . . . 0.0 103.374 170.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 37.17 78.7 0.03 OUTLIER 'General case' 0 C--O 1.248 0.976 0 O-C-N 125.462 1.726 . . . . 0.0 114.418 170.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.34 46.32 0.05 OUTLIER Glycine 0 N--CA 1.424 -2.108 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.705 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.515 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 1.4 tmtp? -74.39 83.44 1.94 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-O 122.997 1.38 . . . . 0.0 107.687 174.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -161.14 -50.17 0.04 OUTLIER 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 103.093 -2.929 . . . . 0.0 103.093 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.88 -50.55 13.09 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 170.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.13 142.84 26.76 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -114.29 -0.92 13.72 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 117.346 0.573 . . . . 0.0 111.369 -174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.65 134.0 50.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.237 0.542 . . . . 0.0 112.191 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 91' ' ' ALA . . . . . 0.444 ' HA ' ' OE1' ' X' ' 4' ' ' GLU . . . -94.92 128.78 41.97 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 174.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.22 17.87 21.47 Favored Glycine 0 C--N 1.308 -0.979 0 C-N-CA 119.535 -1.317 . . . . 0.0 115.343 -170.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 93' ' ' THR . . . . . 0.621 HG22 ' CZ3' ' X' ' 7' ' ' TRP . 72.7 p -105.35 150.32 25.32 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 117.56 0.68 . . . . 0.0 109.4 -178.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 75' ' ' THR . . . -91.15 -1.98 71.76 Favored Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 117.768 -2.158 . . . . 0.0 110.576 171.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -99.65 -74.98 0.58 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.02 13.54 26.71 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -170.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 61.9 m -62.46 104.93 0.56 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.229 0.537 . . . . 0.0 111.586 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -132.0 177.22 7.72 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -117.27 -45.37 2.74 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.097 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 m -122.32 70.92 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 58.4 97.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.163 1.785 . . . . 0.0 114.84 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 69.26 2.38 3.65 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 125.298 1.439 . . . . 0.0 112.884 174.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 28.1 t70 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.154 -178.359 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -98.51 59.99 1.31 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 123.005 1.383 . . . . 0.0 109.258 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -148.74 156.93 43.04 Favored 'General case' 0 C--N 1.282 -2.362 0 CA-C-N 113.264 -1.789 . . . . 0.0 106.23 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.462 ' HG2' ' HZ3' ' X' ' 32' ' ' LYS . 3.7 mp0 -121.51 165.7 15.25 Favored 'General case' 0 N--CA 1.404 -2.75 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 144.5 34.08 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 167.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.647 ' CZ ' ' HA3' ' X' ' 94' ' ' GLY . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 12' ' ' ASN . . . . . 0.547 ' O ' HG23 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.586 ' HG2' ' HB3' ' X' ' 68' ' ' PHE . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' X' ' 71' ' ' ASP . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.465 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.589 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.666 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.735 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.666 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.591 HG21 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.425 ' HZ ' ' HA ' ' X' ' 4' ' ' GLU . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.423 HG22 ' H ' ' X' ' 39' ' ' GLU . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 39' ' ' GLU . . . . . 0.423 ' H ' HG22 ' X' ' 38' ' ' THR . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.459 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.541 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 45' ' ' PHE . . . . . 0.537 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' X' ' 51' ' ' LYS . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 53' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.477 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.591 ' CE2' HG21 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.597 ' ND2' ' H ' ' X' ' 58' ' ' VAL . 3.1 t-20 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.735 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.735 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.506 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 66' ' ' GLU . . . . . 0.493 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.495 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.586 ' HB3' ' HG2' ' X' ' 13' ' ' ARG . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.547 HG23 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.414 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.645 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.511 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 38.0 tp -75.54 104.67 6.19 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -128.88 129.2 45.23 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.922 172.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 62.25 23.08 13.62 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.868 0.867 . . . . 0.0 113.312 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 42.3 t -128.64 -1.36 5.46 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.627 -0.671 . . . . 0.0 110.443 -177.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.312 14.5 pt-20 59.18 -30.07 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.832 2.453 . . . . 0.0 115.544 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.22 -106.17 0.84 Allowed Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 119.116 -1.516 . . . . 0.0 116.862 169.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' X' ' 85' ' ' LYS . 3.8 ttmp? -78.73 96.4 5.56 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.818 -0.691 . . . . 0.0 112.182 -168.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -179.96 -53.68 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.083 0 C-N-CA 124.384 1.074 . . . . 0.0 108.764 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.47 150.92 41.28 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.716 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.28 136.35 14.34 Favored Glycine 0 N--CA 1.428 -1.834 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -161.33 85.73 0.66 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.45 -65.45 1.01 Allowed 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.184 -178.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.81 101.69 14.28 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -92.26 -9.58 61.76 Favored Glycine 0 CA--C 1.496 -1.098 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 2.7 m -61.34 115.25 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 124.601 1.16 . . . . 0.0 109.753 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.647 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -68.83 83.67 0.21 Allowed Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.006 -1.092 . . . . 0.0 111.1 171.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.26 119.96 8.35 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -177.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.03 17.41 6.7 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.21 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -83.4 87.84 6.98 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.55 151.44 19.58 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.089 -173.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -108.0 11.96 27.37 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.846 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 56.4 t 68.41 83.76 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.589 1.155 . . . . 0.0 111.008 177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 72.14 -32.09 0.24 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.27 1.428 . . . . 0.0 113.143 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.71 -47.89 65.24 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.66 0.784 . . . . 0.0 111.622 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.016 -174.814 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.511 -0.526 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -167.41 99.99 0.5 Allowed 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -113.16 132.49 55.45 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.387 0.613 . . . . 0.0 110.019 -177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' X' ' 89' ' ' ASN . 22.0 mt-10 -127.49 157.99 38.59 Favored 'General case' 0 C--N 1.275 -2.668 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.718 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 -75.6 -179.11 4.47 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 6' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.718 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.682 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.405 ' HD3' ' HB2' ' X' ' 68' ' ' PHE . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.52 ' HZ1' ' HD1' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.568 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.638 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.649 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.589 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.599 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.593 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.676 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' X' ' 78' ' ' TYR . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.49 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 50' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' CB ' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.638 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.568 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.676 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.728 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.728 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.521 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 63' ' ' LEU . . . . . 0.521 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.54 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 65' ' ' GLN . . . . . 0.592 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.576 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.52 ' HD1' ' HZ1' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.571 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.682 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.588 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 79' ' ' LEU . . . . . 0.745 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp -60.86 121.27 11.92 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 89.9 m -128.54 136.77 51.22 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.631 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 t70 81.4 -71.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.148 1.379 . . . . 0.0 114.073 170.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 82' ' ' CYS . . . . . 0.425 ' O ' HD11 ' X' ' 79' ' ' LEU . 0.6 OUTLIER -79.8 75.21 6.5 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 83' ' ' GLU . . . . . 0.457 ' HA ' HD21 ' X' ' 79' ' ' LEU . 35.6 tt0 -64.48 -32.24 73.79 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.865 175.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -110.19 135.05 12.59 Favored Glycine 0 N--CA 1.428 -1.897 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.75 84.26 2.09 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 118.216 1.008 . . . . 0.0 113.078 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -80.16 -48.61 12.88 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.1 107.26 11.98 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 174.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.82 160.42 9.87 Favored Glycine 0 N--CA 1.423 -2.231 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 89' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' X' ' 4' ' ' GLU . 6.9 p30 -176.44 146.4 0.62 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -166.89 92.18 0.43 Allowed 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.417 175.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.67 99.96 12.46 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 174.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.81 9.33 Favored Glycine 0 N--CA 1.437 -1.268 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.246 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.9 m -48.12 118.25 2.3 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 125.08 1.352 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.14 48.86 2.49 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.952 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -105.44 158.26 16.78 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 124.577 1.151 . . . . 0.0 108.069 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -75.75 78.48 2.7 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.241 0.543 . . . . 0.0 112.117 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 97' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' X' ' 103' ' ' ASP . 17.0 p -107.04 121.3 44.21 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 174.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.23 -29.75 26.25 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 72.43 12.45 5.61 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.103 1.361 . . . . 0.0 112.751 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 50.1 t -72.91 -56.38 9.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.82 42.23 1.65 Allowed 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . 0.315 1.3 pm0 42.53 57.56 3.41 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.503 -175.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 103' ' ' ASP . . . . . 0.539 ' O ' ' HA ' ' X' ' 97' ' ' SER . 34.3 t70 . . . . . 0 CA--C 1.483 -1.604 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 -177.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.496 -1.129 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -110.67 61.23 0.61 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 3' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' X' ' 85' ' ' LYS . 70.6 ttt180 -163.55 124.84 2.36 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 -172.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.489 ' CG ' ' HG2' ' X' ' 32' ' ' LYS . 1.0 OUTLIER -54.21 133.11 44.44 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.161 0.913 . . . . 0.0 113.052 -173.208 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.602 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 -64.1 164.07 11.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.147 -1.388 . . . . 0.0 110.584 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 6' ' ' CYS . . . . . 0.479 ' HA ' ' ND2' ' X' ' 89' ' ' ASN . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.64 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 10' ' ' TYR . . . . . 0.576 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 11' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.647 ' NZ ' ' HB2' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 17' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 19' ' ' ASP . . . . . 0.458 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.484 ' HG3' HD21 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.448 ' HB2' HG21 ' X' ' 58' ' ' VAL . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.484 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.584 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.656 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.656 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.64 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.533 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.414 ' HA ' ' HE3' ' X' ' 37' ' ' LYS . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 38' ' ' THR . . . . . 0.437 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 39' ' ' GLU . . . . . 0.437 ' H ' HG22 ' X' ' 38' ' ' THR . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 40' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' X' ' 58' ' ' VAL . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.675 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 42' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.609 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 46' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.584 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.704 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 3.6 t-20 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.74 HG12 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.74 ' H ' HG12 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 60' ' ' GLY . . . . . 0.455 ' H ' ' HE1' ' X' ' 42' ' ' TYR . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 63' ' ' LEU . . . . . 0.484 HD21 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 64' ' ' ASP . . . . . 0.523 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.625 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 70' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.526 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.554 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.466 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.576 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 78' ' ' TYR . . . . . 0.496 ' CE2' ' HB ' ' X' ' 80' ' ' THR . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 79' ' ' LEU . . . . . 0.477 ' HB3' ' HB2' ' X' ' 42' ' ' TYR . 15.5 tp -79.6 109.11 13.67 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 80' ' ' THR . . . . . 0.496 ' HB ' ' CE2' ' X' ' 78' ' ' TYR . 14.4 t -127.71 121.73 31.09 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.367 172.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 37.0 t70 52.58 73.28 0.35 Allowed 'General case' 0 C--O 1.244 0.803 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 10.8 t -165.67 35.08 0.05 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -72.62 136.26 45.68 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.332 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.04 -33.61 3.47 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.433 ' O ' ' HD3' ' X' ' 3' ' ' ARG . 40.4 mmtt 63.68 34.98 11.79 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.772 1.629 . . . . 0.0 110.288 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.38 0.97 43.85 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.002 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -100.14 141.08 33.45 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.79 56.44 4.86 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.874 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 89' ' ' ASN . . . . . 0.479 ' ND2' ' HA ' ' X' ' 6' ' ' CYS . 7.0 t30 -81.08 108.09 14.45 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.33 -46.04 21.08 Favored 'General case' 0 C--N 1.293 -1.884 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.868 -176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.51 -84.5 0.66 Allowed 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.564 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.42 32.14 48.44 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 93' ' ' THR . . . . . 0.452 ' HA ' ' CD1' ' X' ' 9' ' ' PHE . 3.9 t -150.12 145.87 26.58 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 114.955 -0.623 . . . . 0.0 109.653 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.402 ' HA2' HG21 ' X' ' 75' ' ' THR . . . 69.59 -92.3 0.34 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.102 -177.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 36.5 t70 56.07 -96.33 0.06 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.98 1.312 . . . . 0.0 112.692 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 53.49 -95.25 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.171 0.988 . . . . 0.0 111.912 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.7 m -170.13 173.88 5.68 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 103.833 -2.655 . . . . 0.0 103.833 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -81.78 81.8 7.68 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 175.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.9 106.63 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 m -122.75 106.82 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.33 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 75.62 -43.33 0.49 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.494 1.518 . . . . 0.0 112.632 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -136.55 -45.77 0.61 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 CA--C 1.499 -1.017 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -137.27 99.62 4.03 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -166.0 176.56 7.67 Favored 'General case' 0 CA--C 1.487 -1.48 0 C-N-CA 126.287 1.835 . . . . 0.0 106.1 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 4' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' X' ' 32' ' ' LYS . 0.5 OUTLIER -121.32 128.78 52.65 Favored 'General case' 0 CA--C 1.472 -2.034 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 166.345 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 5' ' ' ASP . . . . . 0.532 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 4.0 t70 -86.89 178.57 6.93 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.6 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 7' ' ' TRP . . . . . 0.41 ' CZ3' HG21 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 9' ' ' PHE . . . . . 0.72 ' CE1' ' HA3' ' X' ' 94' ' ' GLY . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 11' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 12' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' X' ' 72' ' ' GLU . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 13' ' ' ARG . . . . . 0.66 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 14' ' ' LYS . . . . . 0.66 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 21' ' ' SER . . . . . 0.406 ' O ' HG22 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.6 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 23' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 27' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 28' ' ' LEU . . . . . 0.668 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 30' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 32' ' ' LYS . . . . . 0.668 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 33' ' ' LYS . . . . . 0.704 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 34' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 35' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 36' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 37' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 43' ' ' ILE . . . . . 0.561 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 44' ' ' VAL . . . . . 0.41 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.63 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 53' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 54' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 55' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 56' ' ' ASN . . . . . 0.6 ' HA ' ' CD1' ' X' ' 22' ' ' PHE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 58' ' ' VAL . . . . . 0.676 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 59' ' ' ASP . . . . . 0.676 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 67' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 68' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 71' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 72' ' ' GLU . . . . . 0.469 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 74' ' ' PHE . . . . . 0.63 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 75' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 76' ' ' GLU . . . . . 0.479 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 77' ' ' ASN . . . . . 0.433 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp -87.57 101.86 14.04 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.2 t -126.83 126.57 43.57 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.128 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 p30 54.05 -20.84 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 119.094 2.998 . . . . 0.0 119.094 169.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 25.6 t -79.11 -2.19 39.46 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 118.659 0.663 . . . . 0.0 110.687 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -40.83 119.49 1.14 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.736 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 123.09 38.54 0.56 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 85' ' ' LYS . . . . . 0.532 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 0.3 OUTLIER -73.72 121.85 21.44 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -157.52 173.02 17.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 68.22 18.92 9.21 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.573 1.149 . . . . 0.0 110.394 -176.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 88' ' ' GLY . . . . . 0.473 ' O ' ' HE3' ' X' ' 85' ' ' LYS . . . -168.9 164.4 38.05 Favored Glycine 0 N--CA 1.413 -2.851 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -168.38 -179.01 3.78 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 117.031 0.415 . . . . 0.0 109.93 -176.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . 71.01 26.79 3.47 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 125.514 1.525 . . . . 0.0 113.162 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -145.87 118.32 8.5 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.658 -0.817 . . . . 0.0 112.84 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.98 66.06 0.18 Allowed Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.636 177.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 23.3 p -160.98 173.02 15.87 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 105.062 -2.199 . . . . 0.0 105.062 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 94' ' ' GLY . . . . . 0.72 ' HA3' ' CE1' ' X' ' 9' ' ' PHE . . . -88.84 13.98 61.46 Favored Glycine 0 N--CA 1.427 -1.918 0 C-N-CA 117.549 -2.262 . . . . 0.0 112.409 173.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -104.91 -40.51 5.91 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -80.42 74.04 7.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.822 0.82 . . . . 0.0 109.327 173.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m -147.64 26.17 1.04 Allowed 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.07 154.51 31.3 Favored 'General case' 0 C--O 1.253 1.251 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.357 -173.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -75.21 68.86 2.01 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.082 0.944 . . . . 0.0 110.752 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 100' ' ' VAL . . . . . 0.502 HG23 ' H ' ' X' ' 101' ' ' ASP . 1.6 m -130.01 -80.69 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.283 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 101' ' ' ASP . . . . . 0.502 ' H ' HG23 ' X' ' 100' ' ' VAL . 6.6 m-20 -116.83 7.15 13.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.334 0.588 . . . . 0.0 109.807 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -103.29 -18.74 14.74 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.682 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.428 -1.55 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 177.408 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.562 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.407 -2.619 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . 0.621 ' O ' HD12 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.451 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.495 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.672 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . 0.406 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.455 ' HD1' ' HA ' ' X' ' 56' ' ' ASN . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.56 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.595 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.517 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.574 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.574 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.595 HG21 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.486 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . 0.408 ' HB3' ' CE1' ' X' ' 42' ' ' TYR . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.56 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.469 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.672 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . 0.693 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . 0.513 ' OG1' HG23 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.452 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.595 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . 0.486 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.702 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.702 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.517 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.489 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.547 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.693 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.495 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . 0.621 HD12 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.539 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.421 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . 0.458 ' HB3' ' HD2' ' X' ' 13' ' ' ARG . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.44 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB3' ' X' ' 11' ' ' ALA . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.721 ' HA ' ' HE3' ' X' ' 14' ' ' LYS . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.469 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.505 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.604 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.559 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.649 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.539 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.66 ' HB ' HD22 ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.457 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.56 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.604 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.66 HD22 ' HB ' ' X' ' 43' ' ' ILE . 12.6 t30 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.657 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.657 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.456 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . 0.456 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.666 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.52 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.587 ' HB2' ' HZ1' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.489 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.48 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.252 1.235 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.734 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.712 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.563 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.511 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.412 ' HB3' ' CG2' ' X' ' 58' ' ' VAL . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.511 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.582 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.675 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.517 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.563 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . 0.563 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.427 ' HA ' ' HB3' ' X' ' 79' ' ' LEU 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.49 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.414 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.563 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . 0.417 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . 0.417 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.49 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.775 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.775 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.421 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.533 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.533 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.461 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.485 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.402 ' HG2' ' NE2' ' X' ' 65' ' ' GLN . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.712 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' X' ' 42' ' ' TYR . 36.5 tp . . . . . 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.437 ' HB2' ' CD1' ' X' ' 7' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.658 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.684 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.488 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.614 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . 0.451 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.704 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.704 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.711 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.48 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.491 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . 0.491 ' H ' HG22 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' X' ' 59' ' ' ASP . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.711 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.587 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.403 HG21 ' CZ2' ' X' ' 7' ' ' TRP . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.658 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' X' ' 52' ' ' GLU . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.438 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' X' ' 47' ' ' ASP . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.544 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.587 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.741 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.741 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . 0.457 HD12 HG21 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.458 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.623 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' X' ' 14' ' ' LYS . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.573 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.581 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . 0.509 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.531 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . 0.706 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' X' ' 13' ' ' ARG . 0.8 OUTLIER -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.589 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.707 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.595 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.572 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.681 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.503 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.717 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.531 ' HE3' ' CH2' ' X' ' 7' ' ' TRP . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.583 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.548 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.451 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . 0.451 ' H ' HG22 ' X' ' 38' ' ' THR . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.639 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.564 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.454 ' HB ' HD21 ' X' ' 77' ' ' ASN . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.572 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.401 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.572 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.572 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.639 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.745 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.745 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.707 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . 0.423 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.499 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.575 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.452 ' CD2' HD12 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt . . . . . 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 15.7 t70 . . . . . 0 C--O 1.239 0.513 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.539 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.644 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.445 ' N ' HD22 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.486 ' HG3' ' HG2' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.691 ' HB3' ' HB3' ' X' ' 71' ' ' ASP . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.441 ' HB3' HG21 ' X' ' 58' ' ' VAL . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.553 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.502 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.601 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.66 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.772 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . 0.421 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' X' ' 27' ' ' ASP 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.772 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.666 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.604 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.464 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.4 ' HB3' ' CD1' ' X' ' 74' ' ' PHE . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.46 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.496 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.601 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.502 ' CE1' ' HB3' ' X' ' 23' ' ' LYS 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.666 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.715 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.715 ' H ' HG12 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.507 ' O ' HD12 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . 0.604 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.411 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.574 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.643 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.691 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' X' ' 72' ' ' GLU . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.536 ' HD2' ' HZ1' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.644 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.486 ' HG2' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.505 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.242 0.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.645 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.547 ' O ' HG23 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.586 ' HG2' ' HB3' ' X' ' 68' ' ' PHE . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' X' ' 71' ' ' ASP . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.465 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.589 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.666 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.735 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.666 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.591 HG21 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . . . . . . . . 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.423 HG22 ' H ' ' X' ' 39' ' ' GLU . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . 0.423 ' H ' HG22 ' X' ' 38' ' ' THR . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.459 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.541 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . 0.537 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . 0.457 ' HB2' ' NZ ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.477 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.591 ' CE2' HG21 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.543 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 18.6 t30 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.735 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.735 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.506 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . 0.493 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.586 ' HB3' ' HG2' ' X' ' 13' ' ' ARG . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.547 HG23 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.414 HG22 ' ND2' ' X' ' 12' ' ' ASN . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.645 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.511 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 38.0 tp . . . . . 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.718 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.718 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.682 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.405 ' HD3' ' HB2' ' X' ' 68' ' ' PHE . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.52 ' HZ1' ' HD1' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.568 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.638 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.649 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.589 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.599 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.593 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.676 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' X' ' 78' ' ' TYR . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.49 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' CB ' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.638 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.568 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.676 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.728 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.728 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.521 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . 0.521 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.54 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . 0.592 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.576 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.52 ' HD1' ' HZ1' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.571 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.682 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.588 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . 0.745 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.602 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.64 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . 0.576 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.46 ' N ' HD22 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.647 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . 0.458 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.484 ' HG3' HD21 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.448 ' HB2' HG21 ' X' ' 58' ' ' VAL . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.484 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.584 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.656 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.656 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.64 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.533 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.414 ' HA ' ' HE3' ' X' ' 37' ' ' LYS . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . 0.437 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . 0.437 ' H ' HG22 ' X' ' 38' ' ' THR . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' X' ' 58' ' ' VAL . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.675 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.609 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.584 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.704 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 13.8 t30 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.74 HG12 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.74 ' H ' HG12 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . 0.455 ' H ' ' HE1' ' X' ' 42' ' ' TYR . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . 0.484 HD21 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . 0.523 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.625 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.526 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . 0.443 ' ND2' ' HD1' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.554 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.466 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.576 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . 0.433 ' HB2' ' CD1' ' X' ' 43' ' ' ILE . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . 0.477 ' HB3' ' HB2' ' X' ' 42' ' ' TYR . 15.5 tp . . . . . 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 5' ' ' ASP . . . . . 0.419 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 4.0 t70 . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 7' ' ' TRP . . . . . 0.41 ' CZ3' HG21 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 9' ' ' PHE . . . . . 0.504 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 11' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 12' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' X' ' 72' ' ' GLU . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 13' ' ' ARG . . . . . 0.66 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 14' ' ' LYS . . . . . 0.66 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 21' ' ' SER . . . . . 0.406 ' O ' HG22 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.6 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 23' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 27' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 28' ' ' LEU . . . . . 0.668 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 30' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 32' ' ' LYS . . . . . 0.668 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 33' ' ' LYS . . . . . 0.704 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 34' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 35' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 36' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 37' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 43' ' ' ILE . . . . . 0.561 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 44' ' ' VAL . . . . . 0.41 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.63 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 53' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 54' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 55' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 56' ' ' ASN . . . . . 0.6 ' HA ' ' CD1' ' X' ' 22' ' ' PHE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 58' ' ' VAL . . . . . 0.676 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 59' ' ' ASP . . . . . 0.676 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 67' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 68' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 71' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 72' ' ' GLU . . . . . 0.469 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 73' ' ' ASN . . . . . 0.438 HD22 ' N ' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 74' ' ' PHE . . . . . 0.63 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 75' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 76' ' ' GLU . . . . . 0.479 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 77' ' ' ASN . . . . . 0.433 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.52 -0.176 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -82.46 6.72 16.41 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -110.44 97.29 6.77 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.556 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -95.73 167.97 10.95 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.317 1.056 . . . . 0.0 111.194 -175.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.562 ' OD1' ' HG3' ' X' ' 32' ' ' LYS . 0.4 OUTLIER -75.98 136.43 40.01 Favored 'General case' 0 C--N 1.261 -3.258 0 CA-C-N 112.662 -2.063 . . . . 0.0 105.677 165.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . 0.621 ' O ' HD12 ' X' ' 79' ' ' LEU . 0.5 OUTLIER -94.42 112.61 24.4 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -175.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.451 ' HE1' ' CG ' ' X' ' 5' ' ' ASP . 8.0 m0 -95.35 132.41 40.41 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.1 m -103.18 127.53 50.45 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.495 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 17.2 t80 -95.49 141.28 29.21 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.197 -174.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -119.81 -48.49 2.36 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.778 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -172.17 165.39 6.07 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -170.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.35 123.13 28.81 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 4.8 mmp_? -150.67 157.65 43.22 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.337 -169.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.672 ' HE2' ' CE2' ' X' ' 45' ' ' PHE . 0.0 OUTLIER -164.04 142.47 7.41 Favored 'General case' 0 C--O 1.207 -1.179 0 C-N-CA 127.356 2.262 . . . . 0.0 109.322 159.529 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -94.72 23.7 5.22 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 123.462 1.601 . . . . 0.0 107.505 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . 0.406 ' H ' ' C ' ' X' ' 14' ' ' LYS 0.274 40.9 p 43.46 65.93 0.9 Allowed 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.366 -2.197 . . . . 0.0 114.823 -176.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -173.9 140.18 0.72 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.317 177.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -124.34 27.25 7.09 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.046 0.45 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.53 -22.89 67.1 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -62.23 -5.66 2.53 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 47.9 m 70.83 102.66 0.06 Allowed 'General case' 0 C--O 1.257 1.489 0 CA-C-O 122.686 1.231 . . . . 0.0 113.374 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.455 ' HD1' ' HA ' ' X' ' 56' ' ' ASN . 9.2 m-85 -128.64 155.14 45.47 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 114.265 -1.334 . . . . 0.0 108.075 -175.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.56 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 60.9 mtpt -123.29 145.52 48.64 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.595 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.6 ttpt -120.7 118.77 30.93 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 122.531 1.158 . . . . 0.0 113.129 -177.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 16.1 m -151.67 131.01 12.86 Favored 'General case' 0 C--N 1.271 -2.82 0 N-CA-C 101.009 -3.701 . . . . 0.0 101.009 170.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 6.2 m -108.18 96.23 6.22 Favored 'General case' 0 N--CA 1.41 -2.462 0 C-N-CA 115.117 -2.633 . . . . 0.0 110.781 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.517 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 10.2 m-20 -134.71 120.66 19.75 Favored 'General case' 0 CA--C 1.466 -2.271 0 C-N-CA 127.339 2.256 . . . . 0.0 104.984 167.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.574 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 41.0 tp -54.75 -45.67 74.2 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.56 -46.99 85.71 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.702 177.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' X' ' 33' ' ' LYS . 21.0 mm-40 -61.34 -41.68 97.43 Favored 'General case' 0 CA--C 1.495 -1.167 0 CA-C-O 121.436 0.636 . . . . 0.0 110.617 -177.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.9 m -62.97 -43.01 99.97 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.299 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.574 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 3.5 mptp? -63.36 -46.22 87.57 Favored 'General case' 0 CA--C 1.454 -2.712 0 CA-C-O 122.021 0.915 . . . . 0.0 108.783 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 26.6 pttt -61.45 -43.32 99.07 Favored 'General case' 0 N--CA 1.395 -3.218 0 CA-C-N 113.437 -1.71 . . . . 0.0 109.726 -175.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.595 HG21 ' CE1' ' X' ' 55' ' ' TYR . 20.2 m -62.75 -42.0 99.47 Favored 'General case' 0 N--CA 1.416 -2.145 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.555 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 48.1 t -60.06 -48.19 82.76 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 123.719 0.637 . . . . 0.0 109.468 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.23 -36.11 82.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 51.8 mtmt -58.05 -51.57 69.13 Favored 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.486 HG21 ' O ' ' X' ' 57' ' ' VAL . 0.2 OUTLIER -73.07 -148.26 0.02 OUTLIER 'General case' 0 C--N 1.398 2.684 0 C-N-CA 112.519 -3.673 . . . . 0.0 114.485 -168.149 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -78.54 -56.32 4.52 Favored 'General case' 0 CA--C 1.455 -2.694 0 CA-C-O 124.922 2.296 . . . . 0.0 112.575 163.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . 0.408 ' HB3' ' CE1' ' X' ' 42' ' ' TYR . 7.3 m-85 -65.61 -34.44 78.24 Favored 'General case' 0 CA--C 1.461 -2.463 1 CA-C-N 107.556 -4.384 . . . . 0.0 113.459 -159.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.4 t 16.48 83.76 0.01 OUTLIER 'General case' 0 N--CA 1.522 3.166 0 O-C-N 125.64 1.837 . . . . 0.0 113.536 -167.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.408 0.0 OUTLIER -159.48 -35.59 0.06 Allowed 'General case' 0 C--N 1.352 0.682 0 N-CA-C 119.752 3.242 . . . . 0.0 119.752 178.274 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.56 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 16.7 mm -112.46 138.31 42.02 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 C-N-CA 114.856 -2.738 . . . . 0.0 109.267 -172.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.469 ' HB ' ' OD1' ' X' ' 77' ' ' ASN . 57.8 t -136.34 134.34 49.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.672 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 15.5 m-30 -115.64 132.18 56.71 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . 0.693 ' HB2' ' OG1' ' X' ' 75' ' ' THR . 21.0 mt-10 -119.73 146.8 45.3 Favored 'General case' 0 C--N 1.281 -2.396 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.263 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t70 -90.6 118.26 29.9 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . 0.513 ' OG1' HG23 ' X' ' 75' ' ' THR . 2.6 m -72.13 -35.0 68.99 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.821 0.343 . . . . 0.0 111.662 -174.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.83 -46.39 21.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-O 121.759 0.79 . . . . 0.0 110.578 -174.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.452 ' CB ' ' HG3' ' X' ' 52' ' ' GLU . 41.5 m-80 -86.15 -11.51 52.39 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.669 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 62.99 34.75 13.73 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 121.645 0.736 . . . . 0.0 109.999 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' X' ' 24' ' ' LYS . 35.9 mt-10 -94.63 170.13 9.69 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.154 -174.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 48.3 t -130.98 125.75 34.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -175.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.595 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 67.5 m-85 -119.99 127.9 53.05 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 173.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' X' ' 34' ' ' THR . 2.3 p90 -111.39 130.57 55.65 Favored 'General case' 0 C--N 1.244 -3.993 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.074 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.56 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 27.8 t30 -79.77 121.25 25.13 Favored 'General case' 0 CA--C 1.46 -2.488 0 O-C-N 124.178 0.924 . . . . 0.0 109.56 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . 0.486 ' O ' HG21 ' X' ' 38' ' ' THR . 30.3 m -108.19 4.36 9.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 O-C-N 125.64 1.837 . . . . 0.0 111.922 -172.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.702 HG12 ' H ' ' X' ' 59' ' ' ASP . 2.9 t -127.23 179.08 3.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.125 176.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.702 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 p-10 -73.61 116.51 14.28 Favored 'General case' 0 N--CA 1.417 -2.092 0 CA-C-O 122.984 1.373 . . . . 0.0 111.302 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.89 37.17 1.19 Allowed Glycine 1 N--CA 1.393 -4.211 0 N-CA-C 106.351 -2.7 . . . . 0.0 106.351 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 14.5 pt-20 -68.8 -21.14 64.34 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.7 0.13 53.61 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.88 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.81 102.03 5.32 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 116.439 -2.105 . . . . 0.0 107.796 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -98.16 137.6 36.69 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -65.81 -29.31 69.78 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.419 0.628 . . . . 0.0 111.627 -174.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -89.33 -11.61 42.87 Favored 'General case' 0 N--CA 1.419 -2.022 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.211 -171.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.517 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.3 mptt -101.3 -8.06 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.45 1.119 . . . . 0.0 108.543 172.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.489 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 2.1 m-85 -82.3 150.46 27.23 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.813 174.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.94 165.3 11.41 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.684 0 N-CA-C 104.913 -2.255 . . . . 0.0 104.913 -174.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.2 p -82.08 120.17 33.05 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -175.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.547 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 29.8 t70 -104.59 104.37 14.19 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 165.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -54.3 -28.22 40.67 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 125.601 1.561 . . . . 0.0 114.405 -169.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.06 13.42 31.03 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.646 -176.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -132.42 144.73 50.7 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.419 0.628 . . . . 0.0 112.542 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.693 ' OG1' ' HB2' ' X' ' 46' ' ' GLU . 33.4 p -117.36 134.15 55.16 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -118.15 124.35 47.77 Favored 'General case' 0 N--CA 1.423 -1.792 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.488 -172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.495 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 11.5 p30 -134.02 135.51 43.43 Favored 'General case' 0 N--CA 1.406 -2.653 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -138.18 140.56 39.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.9 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . 0.621 HD12 ' O ' ' X' ' 6' ' ' CYS . 20.2 tp -57.71 111.81 1.26 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 34.3 m -125.53 107.28 10.46 Favored 'General case' 0 N--CA 1.42 -1.942 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.527 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 62.6 64.28 0.93 Allowed 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . 0.427 ' HB2' HD11 ' X' ' 79' ' ' LEU . 84.8 m -135.31 -70.71 0.48 Allowed 'General case' 0 C--N 1.29 -2.001 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 175.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.06 20.99 0.28 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.223 1.809 . . . . 0.0 114.258 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.65 177.81 36.01 Favored Glycine 0 N--CA 1.424 -2.157 0 N-CA-C 107.695 -2.162 . . . . 0.0 107.695 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.3 -85.03 0.54 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 117.993 0.897 . . . . 0.0 110.788 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 32.9 t70 59.58 -81.17 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.08 1.352 . . . . 0.0 110.924 -174.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.58 95.68 4.53 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' X' ' 4' ' ' GLU . . . -116.2 107.82 1.72 Allowed Glycine 0 N--CA 1.425 -2.087 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.375 -172.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -159.86 124.49 3.89 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -146.35 97.85 2.99 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.365 0.603 . . . . 0.0 111.717 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.0 82.69 4.23 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.582 0.705 . . . . 0.0 110.038 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -138.7 4.2 2.98 Favored Glycine 0 N--CA 1.439 -1.131 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.078 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . 0.485 ' HB ' ' CD ' ' X' ' 46' ' ' GLU . 16.6 p -70.32 114.77 8.78 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 122.538 0.335 . . . . 0.0 110.213 -176.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' CG2' ' X' ' 75' ' ' THR . . . 62.35 22.08 62.91 Favored Glycine 0 C--N 1.357 1.74 0 C-N-CA 119.97 -1.11 . . . . 0.0 114.128 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -88.44 -33.92 17.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 117.536 0.668 . . . . 0.0 112.05 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.39 149.2 24.62 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m 76.97 91.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.092 1.757 . . . . 0.0 112.213 -178.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -94.27 122.23 36.61 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' X' ' 103' ' ' ASP . 37.5 tt0 -109.4 -66.28 1.07 Allowed 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.44 176.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 44.6 t -88.79 -66.42 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.06 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.174 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -113.55 -85.8 0.58 Allowed 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -110.73 -1.49 16.66 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' X' ' 99' ' ' GLU . 3.7 p30 . . . . . 0 N--CA 1.422 -1.863 0 N-CA-C 102.738 -3.06 . . . . 0.0 102.738 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 . . . . . 0 C--O 1.223 -0.307 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . 0.434 ' OE1' ' HE2' ' X' ' 33' ' ' LYS . 26.6 mt-10 -100.3 -41.55 7.02 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -173.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 71.5 122.64 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.006 1.322 . . . . 0.0 112.15 175.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -58.03 113.63 1.98 Allowed 'General case' 0 CA--C 1.49 -1.349 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.539 ' HB2' ' CE1' ' X' ' 36' ' ' PHE . 1.7 t70 -64.8 -173.73 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 124.812 1.32 . . . . 0.0 112.54 -173.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 m -93.19 109.47 20.98 Favored 'General case' 0 CA--C 1.481 -1.698 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.472 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.421 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 9.7 m0 -103.65 135.94 44.29 Favored 'General case' 0 N--CA 1.392 -3.348 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 177.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 88.6 m -101.05 128.41 47.11 Favored 'General case' 0 C--N 1.26 -3.299 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -175.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' X' ' 75' ' ' THR . 6.9 t80 -88.87 126.94 35.6 Favored 'General case' 0 N--CA 1.396 -3.17 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.999 -171.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -92.02 -59.71 2.04 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . 0.458 ' HB3' ' HD2' ' X' ' 13' ' ' ARG . . . -179.21 162.86 1.23 Allowed 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.44 ' OD1' ' HA ' ' X' ' 75' ' ' THR . 21.2 m-80 -83.08 118.65 23.69 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB3' ' X' ' 11' ' ' ALA . 3.9 ptm180 -156.6 166.13 34.29 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.876 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.721 ' HA ' ' HE3' ' X' ' 14' ' ' LYS . 0.0 OUTLIER -160.88 137.44 8.64 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.357 1.063 . . . . 0.0 111.354 165.274 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -75.68 7.97 3.36 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 124.923 1.289 . . . . 0.0 111.935 -171.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 50.0 p 58.09 59.03 3.26 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.177 0.991 . . . . 0.0 110.305 -174.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -174.44 131.8 0.37 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.585 -176.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -128.98 23.44 5.68 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.79 0.805 . . . . 0.0 109.447 173.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -78.66 -19.39 52.67 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.216 -176.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -58.78 -1.73 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.936 1.694 . . . . 0.0 114.622 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.469 ' HB2' ' CG2' ' X' ' 58' ' ' VAL . 51.3 m 77.16 88.25 0.07 Allowed 'General case' 0 C--O 1.261 1.69 0 CA-C-O 123.106 1.431 . . . . 0.0 113.508 178.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.505 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -126.61 153.35 45.42 Favored 'General case' 0 CA--C 1.483 -1.614 0 CA-C-N 113.558 -1.656 . . . . 0.0 107.397 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.604 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 74.9 mmtt -113.88 140.87 48.0 Favored 'General case' 0 C--N 1.281 -2.396 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' X' ' 54' ' ' TYR . 35.8 tttm -125.9 118.56 25.69 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-O 121.922 0.867 . . . . 0.0 112.78 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -153.31 132.13 12.4 Favored 'General case' 0 C--N 1.282 -2.345 0 N-CA-C 101.876 -3.379 . . . . 0.0 101.876 168.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 14.1 m -88.99 97.89 11.45 Favored 'General case' 0 N--CA 1.423 -1.78 0 C-N-CA 116.068 -2.253 . . . . 0.0 108.567 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.559 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 39.6 m-20 -132.64 108.91 9.36 Favored 'General case' 0 CA--C 1.464 -2.343 0 CA-C-N 113.633 -1.621 . . . . 0.0 108.716 175.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.652 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 6.1 tt -64.98 -47.63 76.87 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.675 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.36 -52.07 63.28 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.881 0.848 . . . . 0.0 110.382 177.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.454 42.9 mt-10 -64.8 -42.46 95.0 Favored 'General case' 0 C--O 1.199 -1.581 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 -174.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 78.6 m -60.29 -47.88 84.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.698 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.652 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 4.9 mptt -63.98 -44.29 93.15 Favored 'General case' 0 CA--C 1.477 -1.86 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -175.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 2.7 ptmm? -62.01 -44.22 97.18 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 113.854 -1.521 . . . . 0.0 110.181 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 37.4 m -61.7 -42.5 99.02 Favored 'General case' 0 C--N 1.37 1.468 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.649 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.38 1.7 m -60.31 -42.08 94.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 176.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.539 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 9.6 m-85 -64.41 -36.02 82.81 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -60.06 -52.23 66.24 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -73.64 -149.44 0.02 OUTLIER 'General case' 0 CA--C 1.602 2.96 0 C-N-CA 111.976 -3.89 . . . . 0.0 111.711 -173.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -82.77 -56.36 3.88 Favored 'General case' 0 CA--C 1.481 -1.7 0 CA-C-O 125.454 2.55 . . . . 0.0 113.044 150.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -64.68 -31.13 72.21 Favored 'General case' 0 CA--C 1.448 -2.951 1 CA-C-N 107.123 -4.581 . . . . 0.0 115.078 -165.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.649 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 4.5 t -73.99 78.48 1.68 Allowed 'General case' 0 C--N 1.288 -2.083 0 CA-C-O 122.619 1.2 . . . . 0.0 110.455 -169.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -129.87 -0.6 4.78 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.131 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.66 ' HB ' HD22 ' X' ' 56' ' ' ASN . 1.7 mp -115.9 132.03 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.11 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 174.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.68 145.71 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.735 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.62 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 22.0 m-30 -122.4 130.56 53.23 Favored 'General case' 0 N--CA 1.409 -2.505 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' X' ' 75' ' ' THR . 62.5 mm-40 -117.33 136.46 53.12 Favored 'General case' 0 C--N 1.275 -2.651 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.4 t70 -93.67 114.47 26.78 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 14.9 t -82.38 -19.37 39.32 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-O 121.053 0.454 . . . . 0.0 111.756 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.9 t -81.48 -46.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.088 0.947 . . . . 0.0 110.031 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.457 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 36.1 m-80 -92.96 -17.69 23.64 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.831 -176.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.9 42.51 7.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.282 -174.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.56 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 34.0 mm-40 -96.81 160.53 14.31 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.986 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 40.9 t -128.7 126.44 40.07 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.158 -171.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' X' ' 24' ' ' LYS . 20.2 m-85 -123.28 126.9 47.75 Favored 'General case' 0 N--CA 1.423 -1.778 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 173.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.604 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 16.3 p90 -116.85 129.44 56.08 Favored 'General case' 0 C--N 1.259 -3.368 0 C-N-CA 119.341 -0.944 . . . . 0.0 110.607 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.66 HD22 ' HB ' ' X' ' 43' ' ' ILE . 12.6 t30 -74.31 121.37 21.22 Favored 'General case' 0 CA--C 1.473 -1.992 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.588 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 35.5 m -107.36 3.22 9.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 O-C-N 124.96 1.413 . . . . 0.0 112.224 -174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.657 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.9 t -116.28 -177.33 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.657 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.1 p-10 -67.92 96.76 0.61 Allowed 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 122.656 1.217 . . . . 0.0 111.436 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.456 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -94.31 0.82 66.4 Favored Glycine 0 CA--C 1.474 -2.473 0 CA-C-N 113.906 -1.497 . . . . 0.0 110.239 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.68 -24.55 67.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 171.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -82.76 -6.64 59.51 Favored 'General case' 0 N--CA 1.405 -2.684 0 CA-C-N 113.549 -1.659 . . . . 0.0 111.256 176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . 0.456 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 89.6 mt -81.48 130.57 35.1 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 116.495 -2.082 . . . . 0.0 109.337 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 9.8 m-20 -95.0 101.25 13.0 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 5.1 mm100 -68.51 -25.81 65.14 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.56 0.695 . . . . 0.0 110.434 -172.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -28.84 54.31 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.965 -0.459 . . . . 0.0 110.835 -175.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.666 ' HD3' ' HB3' ' X' ' 64' ' ' ASP . 9.4 mptt -87.92 15.11 7.6 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 122.047 0.927 . . . . 0.0 110.425 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 5.5 m-85 -78.86 152.34 31.31 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 125.352 1.461 . . . . 0.0 112.37 176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -115.65 165.88 10.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 102.148 -3.279 . . . . 0.0 102.148 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 61.0 t -100.66 119.64 49.04 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 120.8 1.637 . . . . 0.0 115.248 -174.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' X' ' 14' ' ' LYS . 14.7 m-20 -98.22 120.83 39.32 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 162.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.93 -19.41 51.71 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 124.13 0.972 . . . . 0.0 113.235 -172.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -86.32 -18.3 32.3 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.52 -173.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -110.17 158.2 18.59 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -170.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.52 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.301 6.0 m -118.77 134.93 54.8 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 129.639 3.176 . . . . 0.0 106.22 -178.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.587 ' HB2' ' HZ1' ' X' ' 14' ' ' LYS . 16.9 tt0 -120.57 121.08 37.59 Favored 'General case' 0 CA--C 1.491 -1.29 0 C-N-CA 118.729 -1.189 . . . . 0.0 111.905 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.489 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -144.04 126.86 16.25 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.744 -175.226 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.48 ' HB3' HG13 ' X' ' 43' ' ' ILE . 0.0 OUTLIER -116.87 137.4 52.23 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.781 -177.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 37.5 tp -81.48 107.83 14.57 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.505 0.722 . . . . 0.0 111.287 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.9 t -128.76 147.62 50.79 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.728 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 80.11 -55.69 0.37 Allowed 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 165.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 69.1 m -62.01 -74.94 0.08 Allowed 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.453 1.1 pp20? 38.59 61.11 1.24 Allowed 'General case' 0 C--N 1.348 0.533 0 CA-C-O 123.807 1.765 . . . . 0.0 111.215 -162.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.12 92.13 0.14 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.975 -2.85 . . . . 0.0 105.975 -168.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -45.69 107.28 0.1 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.517 1.527 . . . . 0.0 114.475 -171.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -133.45 -53.31 0.89 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.207 0.527 . . . . 0.0 110.573 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.56 32.25 1.1 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.313 0.578 . . . . 0.0 110.38 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -73.15 -14.14 79.15 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.778 -176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -85.12 -12.47 52.8 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.741 0.305 . . . . 0.0 110.766 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -84.52 94.38 8.55 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 65.18 -78.87 0.03 OUTLIER 'General case' 0 C--O 1.239 0.548 0 C-N-CA 125.517 1.527 . . . . 0.0 112.519 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.81 -110.08 3.02 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 121.316 -0.469 . . . . 0.0 112.845 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.3 p -103.96 113.91 27.78 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -173.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 53.32 51.87 44.46 Favored Glycine 0 N--CA 1.475 1.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 113.941 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -123.93 96.13 4.83 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 120.046 -0.661 . . . . 0.0 111.437 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -128.67 133.49 48.24 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 27.0 m -81.42 -49.43 10.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 t70 176.32 -169.01 0.05 Allowed 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -137.31 91.55 2.62 Favored 'General case' 0 C--N 1.289 -2.046 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 176.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 2.1 t -127.58 14.99 3.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 25.1 t70 66.29 78.35 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.211 1.005 . . . . 0.0 108.792 -170.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -162.96 -49.12 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 113.773 -1.558 . . . . 0.0 107.045 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--N 1.311 -1.104 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.442 177.132 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 121.896 0.855 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 2' ' ' GLU . 1.2 pm0 -73.81 25.15 0.07 Allowed 'General case' 0 C--N 1.301 -1.537 0 C-N-CA 127.183 2.193 . . . . 0.0 113.692 -174.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -93.68 -65.1 1.01 Allowed 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.607 ' HG2' ' HG2' ' X' ' 32' ' ' LYS . 24.9 mt-10 -133.79 147.96 51.31 Favored 'General case' 0 N--CA 1.426 -1.667 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -92.64 -176.24 4.21 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -95.27 100.97 12.67 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.192 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.734 ' CH2' ' HG3' ' X' ' 32' ' ' LYS . 1.8 m0 -101.41 146.07 28.1 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 118.07 -1.452 . . . . 0.0 108.122 -177.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.4 m -101.52 130.45 47.8 Favored 'General case' 0 C--N 1.262 -3.232 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.712 ' CD1' ' HB3' ' X' ' 77' ' ' ASN . 17.5 t80 -98.99 142.62 30.25 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.971 -173.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -111.29 -59.04 2.03 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.178 176.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -177.88 165.06 1.98 Allowed 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -173.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.24 118.81 23.39 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.563 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 80.4 mtt180 -153.59 162.22 41.46 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.563 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.2 OUTLIER -158.2 149.73 21.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.916 0.76 . . . . 0.0 111.537 164.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -95.58 40.78 1.11 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 122.311 1.053 . . . . 0.0 108.525 -177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 72.4 p 54.85 7.83 0.19 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 127.526 2.33 . . . . 0.0 116.499 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -147.23 171.94 14.61 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -141.59 28.74 1.78 Allowed 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 124.434 1.094 . . . . 0.0 110.06 -173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -57.7 -20.93 37.64 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.211 1.404 . . . . 0.0 114.574 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.511 ' HB2' ' CZ ' ' X' ' 22' ' ' PHE . 31.4 mmmt -64.55 -2.74 2.53 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -173.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.412 ' HB3' ' CG2' ' X' ' 58' ' ' VAL . 21.6 t 78.12 97.31 0.06 Allowed 'General case' 0 C--O 1.273 2.332 0 CA-C-O 123.028 1.394 . . . . 0.0 111.475 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.511 ' CZ ' ' HB2' ' X' ' 20' ' ' LYS . 16.3 m-85 -125.96 152.28 45.88 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.817 -1.538 . . . . 0.0 109.221 -174.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 56.4 mttp -118.07 140.51 49.66 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.05 144.14 38.68 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.971 0.891 . . . . 0.0 112.339 -179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -153.46 168.69 25.26 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 102.543 -3.132 . . . . 0.0 102.543 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 9.7 p -105.06 94.97 5.53 Favored 'General case' 0 N--CA 1.421 -1.917 0 C-N-CA 113.832 -3.147 . . . . 0.0 108.262 167.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.582 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 42.2 m-20 -134.83 104.11 5.88 Favored 'General case' 0 CA--C 1.46 -2.511 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 172.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.675 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 2.4 mm? -65.78 -47.31 75.58 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 118.48 -1.288 . . . . 0.0 110.518 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -64.48 -51.6 62.18 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 122.061 0.934 . . . . 0.0 109.771 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.39 27.2 mt-10 -64.22 -42.42 96.6 Favored 'General case' 0 C--O 1.186 -2.237 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 61.9 m -56.92 -43.0 80.99 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.033 0.444 . . . . 0.0 111.613 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.734 ' HG3' ' CH2' ' X' ' 7' ' ' TRP . 0.1 OUTLIER -65.35 -44.34 88.02 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.755 -177.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 8.4 pttm -61.14 -45.42 94.73 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.497 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.517 ' O ' ' HG3' ' X' ' 37' ' ' LYS . 11.5 m -62.28 -40.4 96.11 Favored 'General case' 0 N--CA 1.417 -2.094 0 C-N-CA 123.58 0.752 . . . . 0.0 110.838 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 37.9 t -57.83 -45.91 85.52 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.177 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -63.02 -35.15 79.27 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' X' ' 34' ' ' THR 0.394 0.0 OUTLIER -58.49 -41.8 86.17 Favored 'General case' 0 N--CA 1.392 -3.355 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 179.617 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.563 HG22 ' OE2' ' X' ' 39' ' ' GLU . 0.8 OUTLIER -71.47 -149.1 0.02 OUTLIER 'General case' 0 C--N 1.401 2.819 0 C-N-CA 112.781 -3.568 . . . . 0.0 114.389 -169.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . 0.563 ' OE2' HG22 ' X' ' 38' ' ' THR 0.504 1.5 pm0 -78.85 -58.08 3.43 Favored 'General case' 0 CA--C 1.463 -2.386 0 N-CA-C 117.114 2.264 . . . . 0.0 117.114 165.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -66.34 -33.78 76.49 Favored 'General case' 0 CA--C 1.476 -1.879 0 CA-C-N 110.676 -2.965 . . . . 0.0 115.713 -169.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.634 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 48.6 t -4.4 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.701 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -164.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.427 ' HA ' ' HB3' ' X' ' 79' ' ' LEU 0.32 0.0 OUTLIER -160.93 -33.52 0.05 Allowed 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 176.687 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.49 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 25.4 mm -107.57 136.01 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 C-N-CA 116.593 -2.043 . . . . 0.0 107.504 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.414 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 10.8 t -136.24 136.99 48.83 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.189 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.563 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 22.4 m-30 -125.55 130.38 51.6 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . 0.417 ' OE2' ' HB3' ' X' ' 53' ' ' CYS . 34.3 mt-10 -136.15 153.74 51.18 Favored 'General case' 0 C--N 1.266 -3.041 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.536 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER -115.42 143.75 44.82 Favored 'General case' 0 C--N 1.286 -2.192 0 C-N-CA 118.269 -1.373 . . . . 0.0 108.891 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 11.5 t -90.85 -12.53 36.0 Favored 'General case' 0 C--N 1.308 -1.212 0 O-C-N 123.844 0.715 . . . . 0.0 111.637 -173.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 48.8 t -79.34 -45.31 23.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 121.666 0.746 . . . . 0.0 109.626 -177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' OD1' ' X' ' 47' ' ' ASP . 42.2 m-80 -95.76 -23.27 17.04 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.608 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' X' ' 47' ' ' ASP . 63.9 mttp 61.12 50.16 5.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 122.684 1.23 . . . . 0.0 110.853 -172.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -101.42 145.55 28.8 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 112.943 -1.935 . . . . 0.0 108.752 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . 0.417 ' HB3' ' OE2' ' X' ' 46' ' ' GLU . 1.0 OUTLIER -111.9 122.41 47.71 Favored 'General case' 0 N--CA 1.419 -2.001 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.627 -177.769 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' X' ' 45' ' ' PHE . 5.2 m-85 -118.43 126.95 53.14 Favored 'General case' 0 CA--C 1.484 -1.559 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' X' ' 23' ' ' LYS . 4.2 p90 -116.75 134.24 55.03 Favored 'General case' 1 C--N 1.242 -4.072 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.768 -177.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.49 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 31.2 t30 -78.66 121.57 24.86 Favored 'General case' 0 CA--C 1.468 -2.185 0 O-C-N 124.252 0.97 . . . . 0.0 109.619 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 31.1 m -104.97 -9.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 124.935 1.397 . . . . 0.0 111.788 -174.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.775 HG12 ' H ' ' X' ' 59' ' ' ASP . 7.4 t -113.4 -170.29 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.775 ' H ' HG12 ' X' ' 58' ' ' VAL . 4.6 p-10 -59.64 133.79 56.42 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-O 122.718 1.247 . . . . 0.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.421 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -146.74 9.26 1.37 Allowed Glycine 1 C--N 1.249 -4.291 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.786 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -69.2 -20.64 63.99 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.029 0.919 . . . . 0.0 108.855 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -80.91 -11.38 59.59 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.209 175.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -83.44 102.87 12.36 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 117.921 -1.511 . . . . 0.0 109.517 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.533 ' HB2' ' HD3' ' X' ' 67' ' ' LYS . 9.3 m-20 -97.03 121.96 39.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.756 175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.5 mm100 -61.01 -29.17 69.55 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.201 1.401 . . . . 0.0 110.841 -172.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' X' ' 66' ' ' GLU . 2.1 mp0 -72.67 -23.94 60.96 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.862 -175.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.533 ' HD3' ' HB2' ' X' ' 64' ' ' ASP . 7.8 mptt -92.86 -0.36 57.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.158 0.98 . . . . 0.0 109.903 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 22.9 m-85 -79.84 152.32 29.76 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.057 -1.429 . . . . 0.0 110.877 174.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 99.9 t -113.84 164.73 9.6 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 44.4 t -89.29 117.18 32.13 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 CA-C-N 120.53 1.513 . . . . 0.0 114.568 -168.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.461 ' CB ' ' HB2' ' X' ' 14' ' ' LYS . 10.5 t70 -101.77 130.74 48.25 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 104.461 -2.422 . . . . 0.0 104.461 164.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -98.33 7.81 45.7 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.178 0.513 . . . . 0.0 111.728 -170.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -115.36 -20.67 10.2 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.839 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.485 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 12.2 m-85 -102.94 155.37 18.4 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-O 121.043 0.449 . . . . 0.0 111.848 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 74.5 p -117.54 134.57 54.71 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 106.641 -1.615 . . . . 0.0 106.641 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.402 ' HG2' ' NE2' ' X' ' 65' ' ' GLN . 32.4 tt0 -114.12 121.53 44.07 Favored 'General case' 0 N--CA 1.416 -2.151 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.652 -176.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.712 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -143.98 134.87 25.27 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.368 -174.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.69 141.25 43.1 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 119.412 -0.915 . . . . 0.0 112.298 -171.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . 0.473 HD11 ' H ' ' X' ' 83' ' ' GLU . 36.5 tp -84.06 84.4 7.61 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.46 1.124 . . . . 0.0 113.273 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . 0.445 ' O ' ' HB2' ' X' ' 81' ' ' ASP . 8.8 t -129.88 104.79 7.58 Favored 'General case' 0 C--N 1.244 -3.984 0 CA-C-N 113.489 -1.687 . . . . 0.0 106.648 167.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' X' ' 80' ' ' THR . 39.0 t70 167.69 -69.86 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.883 0.873 . . . . 0.0 109.937 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . 0.566 ' HB3' ' O ' ' X' ' 84' ' ' GLY . 97.8 m -87.0 -61.53 1.71 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.694 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . 0.473 ' H ' HD11 ' X' ' 79' ' ' LEU . 1.4 mp0 53.96 55.63 8.11 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 122.859 1.314 . . . . 0.0 108.086 -169.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . 0.566 ' O ' ' HB3' ' X' ' 82' ' ' CYS . . . 131.66 100.39 0.81 Allowed Glycine 0 N--CA 1.409 -3.14 0 N-CA-C 105.692 -2.963 . . . . 0.0 105.692 -169.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' X' ' 4' ' ' GLU . 14.4 tmtt? -50.06 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.513 1.125 . . . . 0.0 111.388 -173.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -120.18 -49.6 2.28 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.3 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.5 -31.42 72.49 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.397 0.618 . . . . 0.0 111.075 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 106.21 -32.4 7.38 Favored Glycine 0 N--CA 1.435 -1.402 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.836 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -65.31 140.65 58.71 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.034 0.445 . . . . 0.0 110.632 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.36 133.23 45.08 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -45.99 55.2 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.308 0.575 . . . . 0.0 109.725 -177.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.44 -63.02 4.38 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 -175.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.1 t 171.33 158.2 0.08 Allowed 'General case' 0 C--O 1.254 1.295 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 175.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.546 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -76.36 175.88 52.49 Favored Glycine 0 C--O 1.238 0.393 0 C-N-CA 118.59 -1.766 . . . . 0.0 112.516 176.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -156.61 -60.88 0.1 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 53.9 86.17 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 125.623 1.569 . . . . 0.0 113.776 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.8 m -84.12 153.34 23.79 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 174.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -80.08 89.47 5.39 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.035 0.445 . . . . 0.0 110.387 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.2 120.86 43.79 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.955 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . 0.331 11.2 p 52.09 -72.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 127.291 2.236 . . . . 0.0 116.872 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -81.13 -18.17 47.36 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 121.193 -0.942 . . . . 0.0 110.817 -174.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -82.28 -31.3 30.13 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.493 -1.237 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.097 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -101.96 4.42 39.98 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.071 0.939 . . . . 0.0 108.504 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -112.21 122.22 47.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.568 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.587 ' O ' ' HA3' ' X' ' 88' ' ' GLY . 34.4 mt-10 -102.95 160.39 14.66 Favored 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.513 ' OD2' ' HG3' ' X' ' 85' ' ' LYS . 0.9 OUTLIER -64.9 -174.62 0.15 Allowed 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 171.314 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . 0.751 ' SG ' ' HG2' ' X' ' 83' ' ' GLU 0.258 1.7 p -93.54 97.05 10.26 Favored 'General case' 0 C--N 1.282 -2.343 0 C-N-CA 117.873 -1.531 . . . . 0.0 113.671 177.607 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' X' ' 5' ' ' ASP . 4.7 m0 -100.84 132.19 46.36 Favored 'General case' 0 C--N 1.291 -1.978 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -103.46 132.05 50.05 Favored 'General case' 0 C--N 1.279 -2.482 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -91.67 127.58 37.18 Favored 'General case' 0 N--CA 1.413 -2.299 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.237 -174.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -91.54 -62.7 1.38 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 119.596 -0.841 . . . . 0.0 110.246 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -175.6 163.82 2.96 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 -174.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 117.48 23.65 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 116.611 -2.036 . . . . 0.0 106.491 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' OE2' ' X' ' 76' ' ' GLU . 87.0 mtt180 -154.8 168.28 27.4 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.658 ' HE3' ' CD2' ' X' ' 45' ' ' PHE . 0.1 OUTLIER -162.54 140.47 8.44 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 160.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . 0.423 ' HB2' ' CG ' ' X' ' 68' ' ' PHE . 1.2 t80 -88.19 43.83 1.15 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.461 0.648 . . . . 0.0 109.781 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.364 20.8 p 61.91 -38.59 0.13 Allowed 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 119.879 3.289 . . . . 0.0 119.879 172.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -117.11 170.46 8.64 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-N 119.57 1.077 . . . . 0.0 112.956 -174.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -126.06 31.95 5.34 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 113.029 -1.896 . . . . 0.0 108.533 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.26 -20.86 45.73 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.823 1.249 . . . . 0.0 111.726 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.684 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -75.74 -1.48 25.13 Favored 'General case' 0 C--N 1.297 -1.714 0 C-N-CA 124.868 1.267 . . . . 0.0 113.76 -178.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.488 ' C ' ' HD1' ' X' ' 22' ' ' PHE . 42.7 m 75.81 96.17 0.07 Allowed 'General case' 0 C--O 1.261 1.689 0 CA-C-O 123.006 1.384 . . . . 0.0 114.177 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.614 ' HE2' ' CD2' ' X' ' 45' ' ' PHE . 6.1 m-30 -121.69 151.58 40.33 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.378 -179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.544 ' HB3' ' CE2' ' X' ' 55' ' ' TYR . 40.8 ttmt -113.11 137.29 51.65 Favored 'General case' 0 C--N 1.275 -2.64 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.4 pttp -121.92 123.37 41.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 122.092 0.949 . . . . 0.0 110.515 -176.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 13.5 m -153.03 131.71 12.32 Favored 'General case' 0 C--N 1.27 -2.885 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . 0.451 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 23.2 m -99.08 97.95 9.02 Favored 'General case' 0 N--CA 1.414 -2.266 0 C-N-CA 114.941 -2.703 . . . . 0.0 110.732 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.704 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 63.4 m-20 -133.34 117.28 17.12 Favored 'General case' 0 CA--C 1.453 -2.75 0 C-N-CA 126.997 2.119 . . . . 0.0 106.67 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.7 tt -64.92 -49.67 69.49 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.396 -176.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.83 -51.31 65.29 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 122.154 0.978 . . . . 0.0 110.113 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.704 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.363 8.5 mp0 -63.11 -39.98 96.29 Favored 'General case' 0 C--O 1.189 -2.128 0 CA-C-N 113.802 -1.544 . . . . 0.0 113.91 -172.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 31.6 m -56.99 -49.75 74.81 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' HG2' ' X' ' 4' ' ' GLU . 0.5 OUTLIER -64.26 -44.87 90.42 Favored 'General case' 0 CA--C 1.471 -2.085 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 5.2 ptmt -61.74 -43.63 98.47 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 113.494 -1.685 . . . . 0.0 110.631 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.3 m -62.76 -42.07 99.51 Favored 'General case' 0 C--N 1.357 0.91 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.711 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 41.2 t -59.16 -45.07 91.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.695 176.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.48 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 19.7 m-30 -62.41 -35.59 79.69 Favored 'General case' 0 CA--C 1.482 -1.666 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -172.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -53.79 -44.37 70.05 Favored 'General case' 0 N--CA 1.41 -2.44 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.491 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.0 OUTLIER -72.92 -149.05 0.02 OUTLIER 'General case' 0 C--N 1.416 3.496 1 C-N-CA 111.172 -4.211 . . . . 0.0 113.636 -172.895 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . 0.491 ' H ' HG22 ' X' ' 38' ' ' THR 0.281 4.0 mp0 -80.07 -56.46 4.22 Favored 'General case' 0 CA--C 1.467 -2.249 0 CA-C-O 124.42 2.057 . . . . 0.0 114.751 164.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' X' ' 59' ' ' ASP . 86.2 m-85 -65.63 -33.25 75.47 Favored 'General case' 0 CA--C 1.459 -2.531 0 CA-C-N 109.224 -3.625 . . . . 0.0 114.827 -165.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.711 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 45.6 t -10.41 98.77 0.01 OUTLIER 'General case' 0 N--CA 1.53 3.535 0 O-C-N 125.673 1.858 . . . . 0.0 115.954 -165.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.483 ' CE2' ' HB3' ' X' ' 61' ' ' GLU 0.254 0.0 OUTLIER -162.14 -14.18 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 179.502 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.587 ' HB ' ' CB ' ' X' ' 56' ' ' ASN . 14.2 mm -127.9 140.58 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 C-N-CA 117.265 -1.774 . . . . 0.0 106.834 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.403 HG21 ' CZ2' ' X' ' 7' ' ' TRP . 5.8 t -137.22 143.99 33.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.658 ' CD2' ' HE3' ' X' ' 14' ' ' LYS . 18.4 m-30 -131.4 130.71 42.93 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 175.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -122.94 155.95 35.7 Favored 'General case' 0 C--N 1.287 -2.15 0 C-N-CA 118.906 -1.118 . . . . 0.0 109.646 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' X' ' 52' ' ' GLU . 7.9 t70 -87.15 122.63 31.22 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 174.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 3.2 m -65.84 -35.76 81.56 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 123.953 0.901 . . . . 0.0 111.76 -173.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 54.4 t -80.3 -45.88 21.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 122.254 1.026 . . . . 0.0 110.465 -170.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.438 ' HB3' ' HG2' ' X' ' 52' ' ' GLU . 35.3 m-80 -93.97 -17.98 22.37 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.916 -175.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 4.9 mmmp? 61.57 35.15 17.45 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.852 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' X' ' 47' ' ' ASP . 8.7 mm-40 -74.4 136.12 42.4 Favored 'General case' 0 CA--C 1.484 -1.577 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.942 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . 0.511 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 41.0 t -111.13 118.18 35.28 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.022 -168.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -120.26 127.29 52.26 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.544 ' CE2' ' HB3' ' X' ' 23' ' ' LYS . 2.7 p90 -117.98 130.63 56.31 Favored 'General case' 0 C--N 1.249 -3.764 0 C-N-CA 119.836 -0.745 . . . . 0.0 111.897 -178.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.587 ' CB ' ' HB ' ' X' ' 43' ' ' ILE . 5.2 t30 -71.91 116.93 12.88 Favored 'General case' 0 CA--C 1.468 -2.175 0 O-C-N 124.222 0.951 . . . . 0.0 109.276 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.0 m -106.97 -18.8 7.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 O-C-N 124.531 1.144 . . . . 0.0 112.24 -173.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.741 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.5 t -107.54 -170.87 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.741 ' H ' HG12 ' X' ' 58' ' ' VAL . 7.8 p-10 -67.48 121.92 16.84 Favored 'General case' 0 C--N 1.286 -2.18 0 CA-C-O 122.244 1.021 . . . . 0.0 110.098 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -145.55 15.99 1.83 Allowed Glycine 0 N--CA 1.409 -3.166 0 CA-C-N 113.753 -1.567 . . . . 0.0 111.103 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' X' ' 42' ' ' TYR . 11.8 pt-20 -69.53 -23.32 63.57 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.86 0.838 . . . . 0.0 108.951 175.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.89 3.15 30.99 Favored 'General case' 0 N--CA 1.427 -1.597 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.944 174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . 0.457 HD12 HG21 ' X' ' 43' ' ' ILE . 72.0 mt -67.58 104.52 1.61 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 117.594 -1.642 . . . . 0.0 107.907 172.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.458 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 5.7 t0 -84.09 100.32 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.739 -1.118 . . . . 0.0 110.025 -170.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 23.1 tp60 -54.83 -42.59 72.1 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -167.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -81.12 -9.6 59.79 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.929 -1.107 . . . . 0.0 112.181 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.623 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 9.2 mptt -94.08 8.01 43.1 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 122.832 1.301 . . . . 0.0 109.489 -177.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 6.0 m-85 -79.4 151.08 31.13 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 113.076 -1.874 . . . . 0.0 110.872 175.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' X' ' 14' ' ' LYS . 62.1 t -115.46 166.62 9.14 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.389 0 N-CA-C 102.141 -3.281 . . . . 0.0 102.141 -175.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 54.2 t -98.13 116.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.334 0 CA-C-N 121.761 2.073 . . . . 0.0 115.704 -171.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.573 ' OD2' ' HB3' ' X' ' 14' ' ' LYS . 5.8 m-20 -98.91 106.33 18.58 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 161.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 1.2 mp0 -63.3 -17.15 62.22 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.25 0.548 . . . . 0.0 111.81 -173.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -91.22 5.38 49.34 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 123.591 0.756 . . . . 0.0 112.113 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -132.27 156.16 47.02 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -118.65 138.75 52.39 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 125.129 1.372 . . . . 0.0 107.553 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.581 ' OE2' ' HB2' ' X' ' 13' ' ' ARG 0.261 5.5 pt-20 -124.23 127.43 47.69 Favored 'General case' 0 CA--C 1.483 -1.605 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.546 176.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -136.89 141.08 42.74 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.238 -174.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.18 141.01 40.07 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 22.7 tp -85.02 116.91 23.68 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 124.682 1.193 . . . . 0.0 108.169 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -125.98 105.48 8.94 Favored 'General case' 0 N--CA 1.428 -1.563 0 C-N-CA 119.043 -1.063 . . . . 0.0 112.09 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 35.72 35.0 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 127.916 2.487 . . . . 0.0 115.599 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.4 p -86.63 -38.09 17.42 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.139 -0.975 . . . . 0.0 110.495 176.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . 0.751 ' HG2' ' SG ' ' X' ' 6' ' ' CYS . 12.7 pt-20 -172.12 -178.71 2.16 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . 0.406 ' C ' ' HD2' ' X' ' 85' ' ' LYS . . . -87.92 -96.53 0.94 Allowed Glycine 0 N--CA 1.423 -2.216 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.513 ' HG3' ' OD2' ' X' ' 5' ' ' ASP . 3.3 mptp? -138.29 77.56 1.63 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -106.51 -64.37 1.18 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.145 0.498 . . . . 0.0 110.053 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -133.42 -33.08 1.12 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . 0.587 ' HA3' ' O ' ' X' ' 4' ' ' GLU . . . 65.09 -131.18 36.04 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.204 -0.758 . . . . 0.0 111.204 -177.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -161.99 173.49 14.36 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -98.81 138.73 35.53 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . 66.46 86.1 0.14 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.849 1.343 . . . . 0.0 112.021 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -110.57 -32.45 2.71 Favored Glycine 0 C--N 1.307 -1.06 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.075 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 9.4 t -110.56 142.21 42.68 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 122.502 -0.411 . . . . 0.0 110.98 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.18 -61.23 1.42 Allowed Glycine 0 C--N 1.338 0.663 0 N-CA-C 114.553 0.581 . . . . 0.0 114.553 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.0 105.14 5.87 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.459 0.704 . . . . 0.0 109.699 -174.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.59 105.58 0.81 Allowed 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 14.9 m -134.2 141.88 47.2 Favored 'General case' 0 N--CA 1.425 -1.689 0 O-C-N 123.696 0.622 . . . . 0.0 110.334 -174.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -89.45 158.76 17.59 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -103.11 -51.27 3.29 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.92 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 m -129.53 73.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 63.64 -72.43 0.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.536 1.535 . . . . 0.0 114.231 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.01 -57.81 4.95 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.268 2.07 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 178.664 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.224 0.059 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -130.65 -10.39 3.99 Favored 'General case' 0 CA--C 1.511 -0.552 0 O-C-N 122.225 -0.297 . . . . 0.0 111.456 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 72.25 152.06 0.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.726 0.811 . . . . 0.0 112.781 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.704 ' HG3' ' HG2' ' X' ' 32' ' ' LYS . 1.2 mp0 60.36 175.97 0.09 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.981 1.313 . . . . 0.0 111.784 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -138.11 -173.85 3.63 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.854 171.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . 0.509 ' O ' ' HG ' ' X' ' 79' ' ' LEU . 12.1 p -96.66 107.17 19.57 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.531 ' CH2' ' HE3' ' X' ' 32' ' ' LYS . 0.3 OUTLIER -113.79 139.09 49.41 Favored 'General case' 0 N--CA 1.41 -2.453 0 N-CA-C 105.704 -1.962 . . . . 0.0 105.704 176.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 9.2 t -103.73 133.19 49.14 Favored 'General case' 0 C--N 1.28 -2.435 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 12.0 t80 -89.68 136.48 33.01 Favored 'General case' 0 N--CA 1.423 -1.815 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.193 -171.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -100.01 -63.77 1.1 Allowed 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.907 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . 0.706 ' O ' ' HG2' ' X' ' 76' ' ' GLU . . . -177.07 166.26 2.4 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 -175.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' X' ' 13' ' ' ARG . 0.8 OUTLIER -82.74 116.49 22.12 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 177.342 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.589 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 18.8 mtp85 -154.16 165.49 36.09 Favored 'General case' 0 CA--C 1.479 -1.75 0 C-N-CA 123.529 0.732 . . . . 0.0 110.672 -175.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.707 ' HA ' ' CD2' ' X' ' 68' ' ' PHE . 1.5 ttmp? -161.71 136.42 7.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -87.07 89.09 7.87 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 170.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 14.2 p -34.69 78.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 129.663 3.185 . . . . 0.0 118.506 -171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 p30 179.03 150.45 0.29 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.503 -1.68 . . . . 0.0 109.079 167.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -115.49 19.89 15.11 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.909 0.861 . . . . 0.0 109.178 174.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -72.49 -20.55 61.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.783 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HD2' ' X' ' 20' ' ' LYS . 0.0 OUTLIER -66.3 -2.71 4.7 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.608 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 23.6 m 80.8 94.84 0.05 OUTLIER 'General case' 0 C--O 1.258 1.541 0 CA-C-O 123.399 1.571 . . . . 0.0 114.936 175.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.595 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 20.9 m-30 -130.32 156.31 44.89 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.572 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 56.4 mtpt -120.7 142.38 49.55 Favored 'General case' 0 C--N 1.284 -2.263 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.68 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -115.22 126.2 54.27 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-O 121.503 0.668 . . . . 0.0 112.075 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 30.4 p -152.15 131.72 13.06 Favored 'General case' 0 C--N 1.284 -2.281 0 N-CA-C 102.863 -3.014 . . . . 0.0 102.863 168.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 23.4 p -94.01 96.06 9.44 Favored 'General case' 0 N--CA 1.422 -1.869 0 C-N-CA 114.932 -2.707 . . . . 0.0 110.188 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.681 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.0 m-20 -134.19 108.87 8.52 Favored 'General case' 0 CA--C 1.456 -2.664 0 C-N-CA 126.759 2.024 . . . . 0.0 105.691 171.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.503 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 40.0 tp -63.34 -48.4 78.15 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.523 -0.871 . . . . 0.0 108.936 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -62.72 -50.61 70.41 Favored 'General case' 0 C--O 1.248 0.976 0 CA-C-O 121.829 0.823 . . . . 0.0 110.338 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.717 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.391 39.5 mt-10 -61.37 -37.89 85.01 Favored 'General case' 0 C--O 1.195 -1.793 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -176.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 63.2 m -55.11 -42.25 72.69 Favored 'General case' 0 C--N 1.292 -1.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.704 ' HG2' ' HG3' ' X' ' 4' ' ' GLU . 3.5 mptt -64.72 -44.06 91.43 Favored 'General case' 0 CA--C 1.473 -1.994 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.717 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 9.0 pttm -60.34 -44.43 95.54 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.161 -177.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.6 m -62.51 -42.11 99.29 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.583 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.435 1.8 m -59.36 -40.27 85.91 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 174.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.548 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.0 m-85 -63.27 -35.38 80.16 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.47 -53.39 58.11 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -176.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.451 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.3 m -73.97 -149.92 0.02 OUTLIER 'General case' 0 C--N 1.406 3.051 0 C-N-CA 112.162 -3.815 . . . . 0.0 111.595 -174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . 0.451 ' H ' HG22 ' X' ' 38' ' ' THR . 33.7 mt-10 -82.3 -58.13 3.07 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 125.707 2.67 . . . . 0.0 113.27 152.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . 0.255 63.1 m-85 -65.63 -30.58 71.31 Favored 'General case' 0 CA--C 1.452 -2.804 1 CA-C-N 107.187 -4.551 . . . . 0.0 116.232 -168.505 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.639 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 5.9 t -70.53 86.52 0.64 Allowed 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 122.341 1.067 . . . . 0.0 110.09 -170.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.1 OUTLIER -135.99 4.07 2.97 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.458 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.564 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 30.5 mm -123.53 135.71 62.45 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.671 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.454 ' HB ' HD21 ' X' ' 77' ' ' ASN . 2.6 t -137.09 147.45 26.96 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -178.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -122.2 129.83 52.63 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -123.91 133.64 53.7 Favored 'General case' 0 C--N 1.29 -1.983 0 C-N-CA 119.179 -1.009 . . . . 0.0 110.326 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.572 ' HB3' ' H ' ' X' ' 52' ' ' GLU . 9.8 t0 -93.35 129.66 39.4 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.162 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 52.4 m -94.02 -29.56 15.15 Favored 'General case' 0 CA--C 1.557 1.226 0 O-C-N 124.128 0.893 . . . . 0.0 111.337 -178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -80.76 -46.39 21.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.896 0.855 . . . . 0.0 110.712 -174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.401 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 39.5 m-80 -96.35 -8.59 32.16 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 113.817 -1.538 . . . . 0.0 110.263 -175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' X' ' 47' ' ' ASP 0.351 0.0 OUTLIER 46.91 67.52 0.77 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.756 1.265 . . . . 0.0 112.047 -172.699 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.572 ' H ' ' HB3' ' X' ' 47' ' ' ASP . 45.8 mt-10 -131.87 178.92 6.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.919 -1.491 . . . . 0.0 109.269 -175.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 44.0 t -151.01 127.97 11.05 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.398 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -121.57 127.58 51.08 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 172.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.572 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 5.4 p90 -111.84 128.27 56.07 Favored 'General case' 0 C--N 1.27 -2.857 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.355 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.639 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.9 t30 -73.56 121.07 20.06 Favored 'General case' 0 CA--C 1.477 -1.836 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.526 -177.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.0 m -109.37 0.98 9.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 O-C-N 124.305 1.003 . . . . 0.0 112.505 -174.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.745 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.7 t -117.57 -171.83 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.745 ' H ' HG12 ' X' ' 58' ' ' VAL . 2.4 m-20 -59.67 99.86 0.07 Allowed 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.839 0.828 . . . . 0.0 110.793 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.88 -6.8 53.92 Favored Glycine 0 N--CA 1.409 -3.155 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.18 -25.18 67.97 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -74.4 -22.95 58.92 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.217 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 94.7 mt -80.96 105.3 12.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 C-N-CA 118.906 -1.118 . . . . 0.0 108.712 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -95.8 123.35 39.34 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.345 -178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 0.0 OUTLIER -62.18 -39.15 91.72 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 125.167 1.387 . . . . 0.0 112.367 -175.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.07 -21.61 66.59 Favored 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.699 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.2 mptt -97.98 5.37 48.9 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.588 0.709 . . . . 0.0 111.284 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.707 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-85 -79.4 148.48 31.97 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.493 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 77.5 t -118.65 145.65 24.37 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.574 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.589 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 6.9 p -65.67 114.25 2.84 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.35 0 N-CA-C 116.231 1.937 . . . . 0.0 116.231 -170.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 36.4 t70 -124.3 95.21 4.46 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 166.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.7 OUTLIER -57.63 -23.97 54.04 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.887 2.475 . . . . 0.0 115.709 -165.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . 0.423 ' OD1' ' HD1' ' X' ' 74' ' ' PHE . 19.4 p30 -57.74 -42.01 83.05 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.499 ' HA ' ' HA ' ' X' ' 47' ' ' ASP . 79.0 m-85 -103.97 167.39 9.8 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.312 0.577 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 36.6 p -117.4 133.21 56.23 Favored 'General case' 0 N--CA 1.405 -2.692 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' X' ' 11' ' ' ALA . 15.8 pt-20 -98.42 121.53 40.46 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 117.701 -1.6 . . . . 0.0 108.832 -176.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.575 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.3 OUTLIER -139.19 122.38 16.94 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 119.028 -1.069 . . . . 0.0 110.427 -178.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.452 ' CD2' HD12 ' X' ' 43' ' ' ILE . 5.3 m-85 -116.75 130.51 56.76 Favored 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.874 -169.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' X' ' 6' ' ' CYS . 6.6 tt -83.69 110.21 18.1 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 173.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 25.7 m -128.81 125.71 38.34 Favored 'General case' 0 C--N 1.261 -3.273 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.058 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 80.72 -67.34 0.12 Allowed 'General case' 0 CA--C 1.499 -1.016 0 C-N-CA 124.949 1.3 . . . . 0.0 113.801 168.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 19.5 p -53.77 -67.83 0.23 Allowed 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 115.54 1.681 . . . . 0.0 115.54 -170.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 56.36 97.14 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.766 0.793 . . . . 0.0 109.678 -167.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.07 164.06 30.67 Favored Glycine 0 C--N 1.286 -2.195 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 -175.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.509 ' HD2' ' N ' ' X' ' 85' ' ' LYS . 3.7 mptp? -92.0 -41.29 10.63 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 118.145 0.972 . . . . 0.0 112.629 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -95.24 -50.88 4.84 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.396 175.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 61.85 -57.98 0.12 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.087 1.755 . . . . 0.0 114.605 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 166.92 -95.8 0.12 Allowed Glycine 0 C--N 1.301 -1.375 0 N-CA-C 108.641 -1.783 . . . . 0.0 108.641 -177.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -111.23 97.52 6.84 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -125.99 105.07 8.63 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . 0.472 ' HB3' ' HB2' ' X' ' 9' ' ' PHE . . . -95.6 103.13 14.99 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.484 0.659 . . . . 0.0 110.822 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -93.78 125.27 8.17 Favored Glycine 0 N--CA 1.42 -2.371 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.448 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 7.1 m 70.25 81.15 0.17 Allowed 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.469 1.108 . . . . 0.0 110.449 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.478 ' HA2' ' CZ ' ' X' ' 9' ' ' PHE . . . 71.95 174.61 22.59 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 119.698 -1.239 . . . . 0.0 114.218 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -163.66 110.82 1.15 Allowed 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.262 0.625 . . . . 0.0 110.217 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 162.48 -42.12 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.649 1.98 . . . . 0.0 105.705 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 2.4 m -46.19 -56.37 5.79 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 112.745 -2.025 . . . . 0.0 113.829 -176.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -103.81 11.48 35.7 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 119.356 -0.938 . . . . 0.0 111.156 -174.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -81.42 87.02 6.21 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 31.6 m -111.39 -48.78 6.3 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 31.1 t70 176.75 -55.04 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.299 0.375 . . . . 0.0 110.066 -176.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.18 -41.21 87.93 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.41 -2.434 0 N-CA-C 102.525 -3.139 . . . . 0.0 102.525 174.5 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 CA--C 1.501 -0.904 0 CA-C-O 121.354 0.597 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -152.29 19.63 0.65 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.506 -176.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtt180 -130.92 -169.79 2.23 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' X' ' 32' ' ' LYS . 0.0 OUTLIER -96.68 145.58 25.65 Favored 'General case' 0 C--N 1.279 -2.494 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.322 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.515 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 15.7 t70 -73.64 179.24 4.24 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 172.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.93 103.75 15.65 Favored 'General case' 0 C--N 1.275 -2.653 0 N-CA-C 115.416 1.636 . . . . 0.0 115.416 -174.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.621 ' CZ3' HG22 ' X' ' 93' ' ' THR . 1.4 m0 -97.93 160.47 14.29 Favored 'General case' 0 N--CA 1.385 -3.712 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -102.62 124.83 48.89 Favored 'General case' 0 C--N 1.25 -3.739 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.644 ' CE1' HG23 ' X' ' 75' ' ' THR . 24.7 t80 -99.3 135.58 40.5 Favored 'General case' 0 N--CA 1.418 -2.066 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.395 -176.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -101.61 -61.2 1.41 Allowed 'General case' 0 C--O 1.249 1.045 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.505 175.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -170.34 165.59 8.79 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.445 ' N ' HD22 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -82.43 114.23 20.73 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 113.52 -3.272 . . . . 0.0 103.8 173.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.486 ' HG3' ' HG2' ' X' ' 76' ' ' GLU . 8.3 ptp180 -156.89 166.23 33.94 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.121 -1.4 . . . . 0.0 111.004 -174.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.691 ' HB3' ' HB3' ' X' ' 71' ' ' ASP . 1.3 ttmp? -157.53 136.83 11.88 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 172.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -77.56 101.17 6.39 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 163.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 29.9 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -172.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -122.46 98.82 6.1 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.15 27.29 1.66 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.026 0.917 . . . . 0.0 110.231 -170.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.62 -20.05 62.03 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.075 1.35 . . . . 0.0 112.859 -176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' X' ' 63' ' ' LEU . 29.8 mmmt -60.38 -4.66 0.91 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -170.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.441 ' HB3' HG21 ' X' ' 58' ' ' VAL . 29.5 t 68.75 90.2 0.1 Allowed 'General case' 0 C--O 1.272 2.255 0 CA-C-O 122.986 1.374 . . . . 0.0 112.963 177.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.553 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 19.0 m-30 -111.98 138.03 49.18 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.037 -1.438 . . . . 0.0 108.418 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.502 ' HB3' ' CE1' ' X' ' 55' ' ' TYR . 56.2 tptt -100.61 137.52 38.91 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.601 ' HD3' ' CZ ' ' X' ' 54' ' ' TYR . 54.6 pttt -129.33 128.8 43.87 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-O 122.367 1.08 . . . . 0.0 112.785 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 45.4 m -152.8 132.53 13.15 Favored 'General case' 0 C--N 1.271 -2.834 0 N-CA-C 102.203 -3.258 . . . . 0.0 102.203 169.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 20.2 m -89.07 96.93 10.93 Favored 'General case' 0 N--CA 1.413 -2.324 0 C-N-CA 115.245 -2.582 . . . . 0.0 110.325 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.66 ' HB3' ' HB2' ' X' ' 30' ' ' GLU . 4.5 t70 -133.79 108.58 8.57 Favored 'General case' 0 CA--C 1.448 -2.949 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.772 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 3.6 mm? -61.39 -38.96 88.95 Favored 'General case' 0 C--N 1.29 -1.979 0 C-N-CA 118.453 -1.299 . . . . 0.0 109.78 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . 0.421 ' HB2' ' OD1' ' X' ' 27' ' ' ASP . 24.3 m-20 -64.71 -50.99 64.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.867 0.841 . . . . 0.0 110.921 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' X' ' 27' ' ' ASP 0.322 52.4 mt-10 -62.49 -40.36 96.44 Favored 'General case' 0 CA--C 1.471 -2.088 0 CA-C-N 114.651 -1.159 . . . . 0.0 113.461 -176.514 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 71.3 m -57.36 -43.31 83.43 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.379 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.772 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.2 mptt -64.31 -45.56 87.38 Favored 'General case' 0 CA--C 1.467 -2.228 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 33.9 pttt -61.42 -45.63 93.5 Favored 'General case' 0 N--CA 1.417 -2.114 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.611 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.496 HG21 ' CE1' ' X' ' 55' ' ' TYR . 26.4 m -62.16 -43.62 98.42 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -178.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.499 4.5 m -60.92 -41.47 96.24 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 176.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 7.8 m-85 -64.74 -37.21 86.83 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 118.703 -1.199 . . . . 0.0 108.099 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 68.3 mttm -63.59 -55.73 21.42 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 120.078 3.362 . . . . 0.0 120.078 -175.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -149.42 0.03 OUTLIER 'General case' 0 C--N 1.395 2.555 0 C-N-CA 113.197 -3.401 . . . . 0.0 113.727 -169.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . 0.256 6.6 mp0 -83.18 -60.11 2.25 Favored 'General case' 0 C--N 1.377 1.761 0 CA-C-O 124.579 2.133 . . . . 0.0 114.111 153.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' X' ' 58' ' ' VAL 0.284 36.4 m-85 -65.58 -30.62 71.38 Favored 'General case' 0 CA--C 1.438 -3.341 0 CA-C-N 108.883 -3.78 . . . . 0.0 115.229 -168.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.666 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 4.9 t -70.93 81.3 0.65 Allowed 'General case' 0 C--O 1.192 -1.96 0 CA-C-O 122.455 1.121 . . . . 0.0 109.327 -173.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.604 ' CE1' ' HG3' ' X' ' 61' ' ' GLU . 0.1 OUTLIER -131.24 10.42 4.89 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.455 179.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 2.2 mt -137.6 143.45 33.89 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.464 HG21 ' CH2' ' X' ' 7' ' ' TRP . 4.5 t -136.13 147.55 28.03 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.4 ' HB3' ' CD1' ' X' ' 74' ' ' PHE . 25.5 m-85 -123.93 130.87 53.29 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . 0.609 ' OE1' ' HB ' ' X' ' 93' ' ' THR . 42.8 mt-10 -124.56 124.24 41.81 Favored 'General case' 0 C--N 1.277 -2.544 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -175.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.46 ' HB2' ' CE1' ' X' ' 74' ' ' PHE . 10.1 t70 -99.22 125.9 44.9 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 29.1 m -94.89 -21.78 18.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 120.954 0.407 . . . . 0.0 111.914 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -79.48 -45.52 23.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 122.239 1.019 . . . . 0.0 109.464 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -87.49 -16.43 34.75 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.181 -1.372 . . . . 0.0 110.239 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 52.64 66.31 1.26 Allowed 'General case' 0 C--O 1.24 0.605 0 O-C-N 124.229 0.955 . . . . 0.0 110.619 -173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.496 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 30.5 mt-10 -135.4 161.74 34.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.112 -1.404 . . . . 0.0 109.325 -177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 45.0 t -129.42 123.71 32.32 Favored 'General case' 0 N--CA 1.426 -1.642 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.601 ' CZ ' ' HD3' ' X' ' 24' ' ' LYS . 5.4 m-85 -120.9 127.45 51.87 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.502 ' CE1' ' HB3' ' X' ' 23' ' ' LYS 0.25 8.2 p90 -112.05 131.59 55.34 Favored 'General case' 0 C--N 1.255 -3.532 0 C-N-CA 119.217 -0.993 . . . . 0.0 111.641 178.528 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.666 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 4.3 t30 -71.09 113.77 8.46 Favored 'General case' 0 CA--C 1.475 -1.912 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.888 -178.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -109.05 -1.72 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 124.864 1.353 . . . . 0.0 113.036 -171.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.715 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.1 t -122.25 -170.92 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.893 0 N-CA-C 105.711 -1.959 . . . . 0.0 105.711 177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.715 ' H ' HG12 ' X' ' 58' ' ' VAL . 6.3 p-10 -53.08 118.83 4.04 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.142 0.973 . . . . 0.0 109.455 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.507 ' O ' HD12 ' X' ' 43' ' ' ILE . . . -127.9 -22.46 1.42 Allowed Glycine 0 C--O 1.18 -3.245 0 CA-C-N 113.531 -1.668 . . . . 0.0 114.025 -173.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . 0.604 ' HG3' ' CE1' ' X' ' 42' ' ' TYR . 45.6 mt-10 -68.96 -19.39 64.17 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 119.196 1.498 . . . . 0.0 108.191 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -65.63 -17.6 64.71 Favored 'General case' 0 N--CA 1.397 -3.101 0 CA-C-N 111.315 -2.675 . . . . 0.0 108.878 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' X' ' 20' ' ' LYS . 77.0 mt -83.71 107.08 15.91 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.411 ' HB3' ' HD3' ' X' ' 67' ' ' LYS . 46.4 t0 -95.13 130.14 41.95 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.537 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -52.29 -43.21 64.33 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 127.744 2.417 . . . . 0.0 114.274 -169.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.97 -18.66 53.33 Favored 'General case' 0 CA--C 1.506 -0.735 0 O-C-N 121.256 -0.902 . . . . 0.0 111.458 -176.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.574 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 8.7 mptt -91.44 13.14 18.45 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 122.257 1.027 . . . . 0.0 110.247 -176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.643 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 3.8 m-85 -85.79 148.42 25.84 Favored 'General case' 0 N--CA 1.427 -1.596 0 CA-C-N 114.217 -1.356 . . . . 0.0 110.078 172.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 41.3 t -118.48 166.0 13.27 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.877 0 N-CA-C 102.078 -3.304 . . . . 0.0 102.078 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.59 115.19 33.99 Favored 'Isoleucine or valine' 0 C--N 1.267 -3.019 0 CA-C-N 122.621 2.464 . . . . 0.0 114.157 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.691 ' HB3' ' HB3' ' X' ' 14' ' ' LYS . 27.8 t70 -120.18 89.63 3.17 Favored 'General case' 0 C--O 1.246 0.916 0 N-CA-C 101.787 -3.412 . . . . 0.0 101.787 167.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' X' ' 72' ' ' GLU . 10.5 pt-20 -72.79 6.03 2.81 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -163.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -75.76 -22.73 56.18 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-O 121.373 0.606 . . . . 0.0 111.172 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.536 ' HD2' ' HZ1' ' X' ' 14' ' ' LYS . 26.5 m-85 -113.11 170.98 7.82 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-O 122.168 0.985 . . . . 0.0 113.122 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.644 HG23 ' CE1' ' X' ' 9' ' ' PHE 0.345 8.5 m -117.92 132.6 56.39 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 128.979 2.912 . . . . 0.0 105.668 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.486 ' HG2' ' HG3' ' X' ' 13' ' ' ARG . 0.0 OUTLIER -119.27 123.31 43.94 Favored 'General case' 0 CA--C 1.479 -1.771 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.821 179.621 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -136.42 146.96 46.99 Favored 'General case' 0 C--N 1.268 -2.963 0 C-N-CA 118.455 -1.298 . . . . 0.0 110.298 -177.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.505 ' HA ' HG12 ' X' ' 43' ' ' ILE . 0.1 OUTLIER -129.86 136.84 50.01 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -120.03 112.01 18.61 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 8.7 t -129.09 107.45 9.6 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.866 168.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 26.7 t70 59.64 90.49 0.06 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.872 1.32 . . . . 0.0 114.535 168.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 1.5 t -139.72 -58.24 0.57 Allowed 'General case' 0 C--N 1.257 -3.439 0 N-CA-C 103.374 -2.824 . . . . 0.0 103.374 170.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 37.17 78.7 0.03 OUTLIER 'General case' 0 C--O 1.248 0.976 0 O-C-N 125.462 1.726 . . . . 0.0 114.418 170.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 142.34 46.32 0.05 OUTLIER Glycine 0 N--CA 1.424 -2.108 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.705 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.515 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 1.4 tmtp? -74.39 83.44 1.94 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-O 122.997 1.38 . . . . 0.0 107.687 174.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -161.14 -50.17 0.04 OUTLIER 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 103.093 -2.929 . . . . 0.0 103.093 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.88 -50.55 13.09 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 170.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.13 142.84 26.76 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -114.29 -0.92 13.72 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 117.346 0.573 . . . . 0.0 111.369 -174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.65 134.0 50.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.237 0.542 . . . . 0.0 112.191 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . 0.444 ' HA ' ' OE1' ' X' ' 4' ' ' GLU . . . -94.92 128.78 41.97 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 174.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.22 17.87 21.47 Favored Glycine 0 C--N 1.308 -0.979 0 C-N-CA 119.535 -1.317 . . . . 0.0 115.343 -170.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . 0.621 HG22 ' CZ3' ' X' ' 7' ' ' TRP . 72.7 p -105.35 150.32 25.32 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 117.56 0.68 . . . . 0.0 109.4 -178.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 75' ' ' THR . . . -91.15 -1.98 71.76 Favored Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 117.768 -2.158 . . . . 0.0 110.576 171.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -99.65 -74.98 0.58 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.02 13.54 26.71 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -170.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 61.9 m -62.46 104.93 0.56 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.229 0.537 . . . . 0.0 111.586 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -132.0 177.22 7.72 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -117.27 -45.37 2.74 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.097 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 m -122.32 70.92 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 58.4 97.47 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.163 1.785 . . . . 0.0 114.84 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 69.26 2.38 3.65 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 125.298 1.439 . . . . 0.0 112.884 174.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 28.1 t70 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.154 -178.359 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -98.51 59.99 1.31 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 123.005 1.383 . . . . 0.0 109.258 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -148.74 156.93 43.04 Favored 'General case' 0 C--N 1.282 -2.362 0 CA-C-N 113.264 -1.789 . . . . 0.0 106.23 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.462 ' HG2' ' HZ3' ' X' ' 32' ' ' LYS . 3.7 mp0 -121.51 165.7 15.25 Favored 'General case' 0 N--CA 1.404 -2.75 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -177.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 144.5 34.08 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 167.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.5 125.12 32.1 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.581 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 3.8 m0 -104.41 143.06 33.52 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 36.0 m -103.49 124.06 48.06 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.647 ' CZ ' ' HA3' ' X' ' 94' ' ' GLY . 5.0 t80 -88.76 127.02 35.59 Favored 'General case' 0 N--CA 1.41 -2.467 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.204 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -98.4 -57.1 2.28 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.29 163.66 1.66 Allowed 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.547 ' O ' HG23 ' X' ' 70' ' ' VAL . 2.8 m-20 -81.98 116.83 21.78 Favored 'General case' 0 N--CA 1.412 -2.341 0 N-CA-C 103.505 -2.776 . . . . 0.0 103.505 173.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.586 ' HG2' ' HB3' ' X' ' 68' ' ' PHE . 14.6 ttm180 -155.62 159.83 39.94 Favored 'General case' 0 N--CA 1.416 -2.164 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -175.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' X' ' 71' ' ' ASP . 0.0 OUTLIER -161.58 137.04 7.62 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 119.763 1.165 . . . . 0.0 112.989 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -88.41 102.6 15.05 Favored 'General case' 0 C--N 1.273 -2.747 0 N-CA-C 102.011 -3.329 . . . . 0.0 102.011 163.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 11.8 p -54.03 70.03 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 126.489 1.915 . . . . 0.0 114.619 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -149.97 128.9 12.56 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.019 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -120.74 20.75 11.65 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-O 121.74 0.781 . . . . 0.0 109.86 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -74.07 -21.1 60.06 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.931 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -59.55 -12.7 6.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.886 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 41.5 m 83.34 91.05 0.03 OUTLIER 'General case' 0 C--O 1.263 1.806 0 CA-C-O 123.187 1.47 . . . . 0.0 114.197 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.465 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 14.2 m-30 -128.84 146.99 50.77 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 113.265 -1.789 . . . . 0.0 106.678 -178.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.589 ' HB2' ' CE2' ' X' ' 55' ' ' TYR . 73.5 mmtt -119.08 148.08 43.44 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 5.7 ttpm? -123.06 124.57 43.41 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 33.4 t -152.07 132.02 13.38 Favored 'General case' 0 C--N 1.278 -2.527 0 N-CA-C 101.965 -3.346 . . . . 0.0 101.965 166.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 20.1 m -91.61 97.67 11.18 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 115.766 -2.374 . . . . 0.0 108.919 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 55.2 m-20 -132.93 117.38 17.61 Favored 'General case' 0 CA--C 1.461 -2.445 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.723 176.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.666 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 25.0 tp -69.16 -48.58 61.89 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 118.263 -1.375 . . . . 0.0 109.298 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.96 -51.29 65.04 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.843 0.83 . . . . 0.0 110.671 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.735 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.339 7.4 mp0 -62.56 -40.17 95.98 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.802 -174.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 68.7 m -57.12 -45.1 83.77 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.666 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 0.3 OUTLIER -65.28 -44.43 88.0 Favored 'General case' 0 CA--C 1.474 -1.972 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.494 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 11.2 ptmt -61.05 -42.75 99.07 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.584 -178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.591 HG21 ' CE2' ' X' ' 55' ' ' TYR . 30.5 m -61.22 -42.09 97.99 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' X' ' 41' ' ' CYS . 51.8 t -59.09 -49.04 79.39 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 176.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.425 ' HZ ' ' HA ' ' X' ' 4' ' ' GLU . 16.5 m-30 -63.69 -36.62 84.46 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -172.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . . . . . . . . 0.358 64.2 pttt -61.04 -41.82 97.32 Favored 'General case' 0 N--CA 1.395 -3.182 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.423 HG22 ' H ' ' X' ' 39' ' ' GLU . 0.7 OUTLIER -71.67 -149.78 0.02 OUTLIER 'General case' 0 CA--C 1.601 2.932 0 C-N-CA 112.628 -3.629 . . . . 0.0 113.991 -170.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . 0.423 ' H ' HG22 ' X' ' 38' ' ' THR . 2.8 mp0 -80.16 -56.54 4.15 Favored 'General case' 0 CA--C 1.457 -2.622 0 O-C-N 118.818 -2.426 . . . . 0.0 113.731 161.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -65.44 -33.08 75.11 Favored 'General case' 0 N--CA 1.41 -2.461 1 CA-C-N 107.997 -4.183 . . . . 0.0 114.751 -162.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' X' ' 35' ' ' CYS . 43.5 t 4.0 89.9 0.01 OUTLIER 'General case' 0 N--CA 1.531 3.622 0 O-C-N 125.847 1.967 . . . . 0.0 115.448 -169.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.459 ' CD1' HG12 ' X' ' 43' ' ' ILE 0.276 0.0 OUTLIER -166.77 -20.7 0.02 OUTLIER 'General case' 0 C--N 1.354 0.779 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 177.318 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 19.7 mm -123.71 138.21 54.26 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 C-N-CA 116.021 -2.271 . . . . 0.0 107.742 -175.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.541 ' HB ' ' ND2' ' X' ' 77' ' ' ASN . 22.0 t -136.89 139.49 44.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . 0.537 ' CE2' ' HE2' ' X' ' 14' ' ' LYS . 11.9 m-30 -119.14 129.92 55.28 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -129.02 153.27 47.75 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 118.421 -1.311 . . . . 0.0 110.057 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' X' ' 51' ' ' LYS . 9.5 t70 -95.08 125.77 39.96 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.9 t -88.36 -21.6 24.25 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.607 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.76 -46.74 19.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 122.473 1.13 . . . . 0.0 109.77 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -91.37 -23.3 20.11 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.046 -1.434 . . . . 0.0 111.196 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.457 ' HB2' ' NZ ' ' X' ' 51' ' ' LYS . 0.1 OUTLIER 61.79 67.39 0.76 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.441 1.115 . . . . 0.0 109.527 -172.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -121.9 145.42 48.11 Favored 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.171 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 49.6 t -113.61 122.19 46.44 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -171.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.477 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 57.4 m-85 -120.37 127.71 52.56 Favored 'General case' 0 CA--C 1.478 -1.812 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.591 ' CE2' HG21 ' X' ' 34' ' ' THR . 0.4 OUTLIER -111.76 130.4 55.81 Favored 'General case' 1 C--N 1.243 -4.041 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.664 -178.385 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.543 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 18.6 t30 -79.87 121.32 25.27 Favored 'General case' 0 CA--C 1.464 -2.353 0 O-C-N 123.928 0.768 . . . . 0.0 108.932 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.27 -2.81 9.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 O-C-N 125.512 1.757 . . . . 0.0 111.746 -173.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.735 HG12 ' H ' ' X' ' 59' ' ' ASP . 4.4 t -118.23 -172.85 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.735 ' H ' HG12 ' X' ' 58' ' ' VAL . 16.6 m-20 -62.09 118.45 7.35 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-O 121.902 0.858 . . . . 0.0 108.713 177.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.506 ' HA3' HG13 ' X' ' 43' ' ' ILE . . . -128.79 3.46 6.48 Favored Glycine 0 C--N 1.258 -3.805 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.14 -176.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.33 -20.82 63.87 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 172.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -74.57 -13.15 60.63 Favored 'General case' 0 N--CA 1.419 -2.025 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.324 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.49 104.37 10.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -89.0 119.92 29.95 Favored 'General case' 0 CA--C 1.495 -1.154 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.361 -175.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 6.0 tp-100 -67.77 -30.7 70.22 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.779 -171.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . 0.493 ' OE2' ' HB3' ' X' ' 65' ' ' GLN . 4.0 mp0 -89.07 -9.46 51.1 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 118.193 -1.403 . . . . 0.0 112.799 -173.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 6.7 mptt -101.69 6.57 41.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 122.617 1.199 . . . . 0.0 109.234 174.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.586 ' HB3' ' HG2' ' X' ' 13' ' ' ARG . 1.3 m-85 -79.6 149.78 31.25 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.294 174.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 64.4 t -116.02 145.91 21.14 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.4 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.547 HG23 ' O ' ' X' ' 12' ' ' ASN . 6.5 p -73.49 114.74 13.45 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.33 0 C-N-CA 117.673 -1.611 . . . . 0.0 114.842 -171.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' X' ' 14' ' ' LYS . 9.6 t70 -105.89 127.48 53.16 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 167.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -89.28 -12.64 40.08 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -170.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -90.36 -23.41 21.11 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 120.028 -0.669 . . . . 0.0 111.542 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 17.1 m-85 -103.52 159.53 15.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.233 0.54 . . . . 0.0 111.865 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.414 HG22 ' ND2' ' X' ' 12' ' ' ASN . 52.4 p -117.61 139.6 50.76 Favored 'General case' 0 C--O 1.262 1.748 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.07 122.3 47.38 Favored 'General case' 0 N--CA 1.409 -2.523 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 176.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.645 ' HB3' ' CD1' ' X' ' 9' ' ' PHE . 0.6 OUTLIER -139.83 119.62 13.36 Favored 'General case' 0 N--CA 1.387 -3.581 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.373 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.511 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.4 OUTLIER -137.3 147.4 45.62 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.042 -169.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 38.0 tp -75.54 104.67 6.19 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 15.0 t -128.88 129.2 45.23 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.922 172.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 62.25 23.08 13.62 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.868 0.867 . . . . 0.0 113.312 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 42.3 t -128.64 -1.36 5.46 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.627 -0.671 . . . . 0.0 110.443 -177.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . 0.312 14.5 pt-20 59.18 -30.07 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.832 2.453 . . . . 0.0 115.544 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.22 -106.17 0.84 Allowed Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 119.116 -1.516 . . . . 0.0 116.862 169.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.476 ' HB2' ' NZ ' ' X' ' 85' ' ' LYS . 3.8 ttmp? -78.73 96.4 5.56 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.818 -0.691 . . . . 0.0 112.182 -168.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -179.96 -53.68 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.083 0 C-N-CA 124.384 1.074 . . . . 0.0 108.764 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.47 150.92 41.28 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.716 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.28 136.35 14.34 Favored Glycine 0 N--CA 1.428 -1.834 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -161.33 85.73 0.66 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.45 -65.45 1.01 Allowed 'General case' 0 N--CA 1.426 -1.662 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.184 -178.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.81 101.69 14.28 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -92.26 -9.58 61.76 Favored Glycine 0 CA--C 1.496 -1.098 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 2.7 m -61.34 115.25 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 124.601 1.16 . . . . 0.0 109.753 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.647 ' HA3' ' CZ ' ' X' ' 9' ' ' PHE . . . -68.83 83.67 0.21 Allowed Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.006 -1.092 . . . . 0.0 111.1 171.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.26 119.96 8.35 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -177.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.03 17.41 6.7 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.21 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -83.4 87.84 6.98 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.55 151.44 19.58 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.089 -173.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -108.0 11.96 27.37 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.846 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 56.4 t 68.41 83.76 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.589 1.155 . . . . 0.0 111.008 177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 18.7 t70 72.14 -32.09 0.24 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.27 1.428 . . . . 0.0 113.143 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -68.71 -47.89 65.24 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.66 0.784 . . . . 0.0 111.622 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.016 -174.814 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.511 -0.526 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -167.41 99.99 0.5 Allowed 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -113.16 132.49 55.45 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.387 0.613 . . . . 0.0 110.019 -177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' X' ' 89' ' ' ASN . 22.0 mt-10 -127.49 157.99 38.59 Favored 'General case' 0 C--N 1.275 -2.668 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.718 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 3.4 t70 -75.6 -179.11 4.47 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' X' ' 79' ' ' LEU . 2.8 m -106.72 98.1 7.81 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.077 -176.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.718 ' HE1' ' HB3' ' X' ' 5' ' ' ASP . 0.0 OUTLIER -109.04 130.82 55.49 Favored 'General case' 0 C--N 1.288 -2.097 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 12.0 t -103.4 135.59 44.73 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.682 ' HD1' ' HB3' ' X' ' 77' ' ' ASN . 6.5 t80 -81.95 127.01 32.61 Favored 'General case' 0 N--CA 1.416 -2.136 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.138 -174.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -96.13 -62.85 1.21 Allowed 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . . . . . . . . . . . -178.08 164.04 1.79 Allowed 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -178.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -81.4 118.38 22.63 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.405 ' HD3' ' HB2' ' X' ' 68' ' ' PHE . 12.4 ptp180 -155.58 164.7 38.29 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.324 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.52 ' HZ1' ' HD1' ' X' ' 74' ' ' PHE . 0.6 OUTLIER -160.56 137.8 9.25 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 171.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -82.83 74.85 9.76 Favored 'General case' 0 N--CA 1.426 -1.655 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.281 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.288 34.7 p 68.15 -47.24 0.53 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 171.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -156.94 164.34 38.13 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -175.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -85.86 34.29 0.6 Allowed 'General case' 0 C--N 1.307 -1.262 0 C-N-CA 124.537 1.135 . . . . 0.0 110.843 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.55 -26.88 67.23 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 123.965 0.906 . . . . 0.0 110.444 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -66.2 -4.55 7.88 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . . . . . . . . . 19.4 m 77.1 89.22 0.07 Allowed 'General case' 0 C--O 1.264 1.823 0 CA-C-O 122.736 1.255 . . . . 0.0 114.328 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 12.6 m-30 -124.77 142.72 51.22 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.568 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 4.0 mptp? -109.37 143.4 38.96 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 120.335 -0.546 . . . . 0.0 109.96 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.638 ' HG3' ' CE1' ' X' ' 54' ' ' TYR . 0.4 OUTLIER -134.13 125.94 28.98 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 122.116 0.96 . . . . 0.0 111.601 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 32.2 m -151.62 130.27 12.3 Favored 'General case' 0 C--N 1.259 -3.357 1 N-CA-C 98.822 -4.51 . . . . 0.0 98.822 164.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -95.92 100.54 12.21 Favored 'General case' 0 N--CA 1.41 -2.472 0 C-N-CA 115.26 -2.576 . . . . 0.0 114.32 -168.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.649 ' HB2' ' HB2' ' X' ' 30' ' ' GLU . 18.7 m-20 -130.1 93.97 3.6 Favored 'General case' 0 CA--C 1.46 -2.492 0 N-CA-C 100.99 -3.708 . . . . 0.0 100.99 170.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.589 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 4.0 mm? -54.2 -47.13 72.44 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.053 -172.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -50.37 72.46 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 173.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.341 30.4 mt-10 -58.42 -37.82 76.15 Favored 'General case' 0 C--O 1.192 -1.945 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.29 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.01 -41.81 75.46 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.15 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.589 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 10.6 mptt -63.5 -46.15 87.44 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 7.4 ptmt -61.9 -42.45 99.09 Favored 'General case' 0 N--CA 1.413 -2.287 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.343 -177.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 14.2 m -60.97 -41.48 96.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.599 ' HA ' ' CB ' ' X' ' 41' ' ' CYS 0.448 1.9 m -57.17 -40.8 78.03 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 174.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.593 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 14.8 m-85 -64.01 -35.16 79.8 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' X' ' 33' ' ' LYS . 98.9 mttt -55.09 -54.59 41.24 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 116.61 2.078 . . . . 0.0 116.61 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.63 -148.71 0.02 OUTLIER 'General case' 0 CA--C 1.604 3.031 0 C-N-CA 112.244 -3.782 . . . . 0.0 111.198 -177.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -81.94 -55.19 4.75 Favored 'General case' 0 CA--C 1.482 -1.663 0 CA-C-O 125.091 2.377 . . . . 0.0 113.482 144.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -64.38 -30.95 71.98 Favored 'General case' 0 CA--C 1.461 -2.449 1 CA-C-N 107.985 -4.188 . . . . 0.0 114.331 -163.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.676 ' HA ' ' O ' ' X' ' 56' ' ' ASN . 6.6 t -71.7 88.5 0.98 Allowed 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.447 1.118 . . . . 0.0 109.734 -172.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.38 4.62 1.8 Allowed 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.195 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' X' ' 78' ' ' TYR . 20.7 mm -122.13 136.17 59.87 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.786 0 N-CA-C 104.143 -2.54 . . . . 0.0 104.143 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 t -136.56 145.9 29.64 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.587 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.315 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -121.02 129.44 53.39 Favored 'General case' 0 N--CA 1.416 -2.14 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 173.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -124.48 135.38 53.16 Favored 'General case' 0 C--N 1.28 -2.448 0 C-N-CA 119.039 -1.064 . . . . 0.0 109.405 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.49 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 13.8 t70 -81.87 123.8 29.14 Favored 'General case' 0 CA--C 1.488 -1.442 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -83.6 -20.53 33.55 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 123.82 0.7 . . . . 0.0 111.788 -174.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 61.5 t -81.21 -46.83 20.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-O 122.18 0.99 . . . . 0.0 109.386 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' X' ' 52' ' ' GLU . 41.0 m-80 -96.64 -19.37 19.07 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 113.547 -1.66 . . . . 0.0 112.193 -173.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 64.95 46.39 2.87 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.923 0.868 . . . . 0.0 109.67 -173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' CB ' ' X' ' 50' ' ' ASN . 56.2 mm-40 -101.11 161.94 13.25 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.414 -1.266 . . . . 0.0 107.946 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 6.0 p -132.1 126.5 33.9 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 119.481 -0.887 . . . . 0.0 111.323 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.638 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 6.2 m-85 -119.51 126.66 51.79 Favored 'General case' 0 CA--C 1.478 -1.789 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.568 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 12.2 p90 -111.91 128.35 56.12 Favored 'General case' 0 C--N 1.258 -3.392 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.871 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.676 ' O ' ' HA ' ' X' ' 41' ' ' CYS . 2.6 t30 -69.25 121.5 16.95 Favored 'General case' 0 CA--C 1.476 -1.876 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.214 178.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -110.44 -1.45 9.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 124.44 1.088 . . . . 0.0 112.626 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.728 HG12 ' H ' ' X' ' 59' ' ' ASP . 11.2 t -108.57 -174.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.728 ' H ' HG12 ' X' ' 58' ' ' VAL . 8.9 m-20 -66.44 98.47 0.49 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 122.206 1.003 . . . . 0.0 110.117 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.521 ' HA2' ' HG ' ' X' ' 63' ' ' LEU . . . -97.23 -4.99 58.31 Favored Glycine 0 N--CA 1.401 -3.64 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.973 -174.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.2 -21.35 66.16 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 172.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -90.43 -10.44 43.78 Favored 'General case' 0 N--CA 1.4 -2.933 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.919 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . 0.521 ' HG ' ' HA2' ' X' ' 60' ' ' GLY . 91.1 mt -67.75 113.1 5.24 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 118.223 -1.391 . . . . 0.0 108.594 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.54 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 3.9 t0 -94.89 99.55 11.58 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.341 -172.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . 0.592 ' O ' ' HB2' ' X' ' 68' ' ' PHE . 1.3 mp0 -56.58 -43.45 80.07 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 125.558 1.543 . . . . 0.0 113.15 -170.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -79.25 -5.86 55.33 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.246 -171.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.576 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 0.1 OUTLIER -108.41 5.31 25.26 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.199 1.0 . . . . 0.0 109.38 179.42 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' X' ' 65' ' ' GLN . 2.2 m-85 -78.75 152.54 31.43 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 125.999 1.72 . . . . 0.0 109.805 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 46.7 t -114.95 164.44 11.31 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 101.861 -3.385 . . . . 0.0 101.861 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . . 84.8 t -100.69 116.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.04 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -170.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.0 103.18 11.63 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 161.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.26 -24.41 64.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 127.765 2.426 . . . . 0.0 114.798 -167.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -67.71 -23.25 65.26 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -173.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.52 ' HD1' ' HZ1' ' X' ' 14' ' ' LYS . 69.1 m-85 -113.9 164.99 13.04 Favored 'General case' 0 CA--C 1.477 -1.837 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.639 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.571 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 64.6 p -117.62 133.7 55.67 Favored 'General case' 0 N--CA 1.406 -2.657 0 N-CA-C 106.09 -1.819 . . . . 0.0 106.09 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -100.48 120.82 40.57 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.305 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.682 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.1 OUTLIER -144.43 131.68 20.69 Favored 'General case' 0 N--CA 1.415 -2.206 0 C-N-CA 119.031 -1.068 . . . . 0.0 110.611 179.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.588 ' HB2' HD12 ' X' ' 43' ' ' ILE . 0.3 OUTLIER -132.91 147.54 52.29 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -167.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . 0.745 ' HA ' ' O ' ' X' ' 6' ' ' CYS . 44.4 tp -60.86 121.27 11.92 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 89.9 m -128.54 136.77 51.22 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.631 170.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 t70 81.4 -71.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.148 1.379 . . . . 0.0 114.073 170.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . 0.425 ' O ' HD11 ' X' ' 79' ' ' LEU . 0.6 OUTLIER -79.8 75.21 6.5 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . 0.457 ' HA ' HD21 ' X' ' 79' ' ' LEU . 35.6 tt0 -64.48 -32.24 73.79 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.865 175.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . -110.19 135.05 12.59 Favored Glycine 0 N--CA 1.428 -1.897 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.75 84.26 2.09 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 118.216 1.008 . . . . 0.0 113.078 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -80.16 -48.61 12.88 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.1 107.26 11.98 Favored 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 174.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.82 160.42 9.87 Favored Glycine 0 N--CA 1.423 -2.231 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' X' ' 4' ' ' GLU . 6.9 p30 -176.44 146.4 0.62 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -166.89 92.18 0.43 Allowed 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.417 175.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.67 99.96 12.46 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 174.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -90.26 26.81 9.33 Favored Glycine 0 N--CA 1.437 -1.268 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.246 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 5.9 m -48.12 118.25 2.3 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 125.08 1.352 . . . . 0.0 111.077 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.14 48.86 2.49 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.952 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -105.44 158.26 16.78 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 124.577 1.151 . . . . 0.0 108.069 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -75.75 78.48 2.7 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.241 0.543 . . . . 0.0 112.117 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' X' ' 103' ' ' ASP . 17.0 p -107.04 121.3 44.21 Favored 'General case' 0 N--CA 1.421 -1.9 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 174.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.23 -29.75 26.25 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 72.43 12.45 5.61 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.103 1.361 . . . . 0.0 112.751 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 50.1 t -72.91 -56.38 9.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -110.82 42.23 1.65 Allowed 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . 0.315 1.3 pm0 42.53 57.56 3.41 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.503 -175.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . 0.539 ' O ' ' HA ' ' X' ' 97' ' ' SER . 34.3 t70 . . . . . 0 CA--C 1.483 -1.604 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 -177.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.496 -1.129 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -110.67 61.23 0.61 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' X' ' 85' ' ' LYS . 70.6 ttt180 -163.55 124.84 2.36 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 -172.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.489 ' CG ' ' HG2' ' X' ' 32' ' ' LYS . 1.0 OUTLIER -54.21 133.11 44.44 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.161 0.913 . . . . 0.0 113.052 -173.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.602 ' HB3' ' HE1' ' X' ' 7' ' ' TRP . 24.5 t0 -64.1 164.07 11.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.147 -1.388 . . . . 0.0 110.584 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . 0.479 ' HA ' ' ND2' ' X' ' 89' ' ' ASN . 2.3 m -101.54 102.66 13.44 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 121.27 0.557 . . . . 0.0 111.136 -173.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.64 ' CH2' ' HE2' ' X' ' 32' ' ' LYS . 0.6 OUTLIER -99.43 136.26 39.63 Favored 'General case' 0 C--N 1.271 -2.828 0 N-CA-C 105.086 -2.19 . . . . 0.0 105.086 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 76.3 p -102.21 133.63 46.79 Favored 'General case' 0 N--CA 1.398 -3.036 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' X' ' 75' ' ' THR . 16.0 t80 -95.91 136.13 36.75 Favored 'General case' 0 N--CA 1.411 -2.378 0 O-C-N 123.707 0.629 . . . . 0.0 109.983 -173.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . 0.576 ' HB3' ' OE2' ' X' ' 76' ' ' GLU . 76.5 t80 -104.69 -59.62 1.72 Allowed 'General case' 0 N--CA 1.417 -2.1 0 C-N-CA 119.588 -0.845 . . . . 0.0 110.404 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' X' ' 76' ' ' GLU . . . -169.29 165.63 10.76 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.46 ' N ' HD22 ' X' ' 12' ' ' ASN . 0.8 OUTLIER -83.48 114.38 21.44 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 112.569 -3.652 . . . . 0.0 103.754 171.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' X' ' 70' ' ' VAL . 99.8 mtt180 -154.55 165.23 37.12 Favored 'General case' 0 CA--C 1.483 -1.621 0 C-N-CA 124.126 0.97 . . . . 0.0 108.884 -176.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.647 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 1.8 ttmp? -163.99 137.62 5.45 Favored 'General case' 0 N--CA 1.412 -2.34 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -87.31 97.97 11.08 Favored 'General case' 0 C--N 1.275 -2.657 0 N-CA-C 100.743 -3.799 . . . . 0.0 100.743 161.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 9.1 p -60.81 66.93 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' X' ' 19' ' ' ASP . 14.4 t70 -129.04 106.75 9.08 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.371 176.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -97.24 13.15 30.43 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.617 0.722 . . . . 0.0 111.387 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . 0.458 ' HB3' ' OD1' ' X' ' 17' ' ' ASP . 17.8 t70 -77.05 -19.89 56.57 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.957 177.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.484 ' HG3' HD21 ' X' ' 63' ' ' LEU . 74.0 mmtt -59.48 -14.65 13.42 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 114.515 -1.22 . . . . 0.0 112.164 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.448 ' HB2' HG21 ' X' ' 58' ' ' VAL . 39.0 m 80.33 96.91 0.05 Allowed 'General case' 0 C--O 1.268 2.035 0 C-N-CA 125.255 1.422 . . . . 0.0 114.693 175.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.484 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.9 m-30 -124.31 155.28 38.96 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 113.739 -1.573 . . . . 0.0 107.59 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.534 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 66.6 mttm -123.17 142.85 50.46 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.584 ' HD3' ' CE1' ' X' ' 54' ' ' TYR . 37.9 ttpt -121.42 128.42 52.15 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 122.063 0.935 . . . . 0.0 111.709 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 17.5 m -151.42 130.59 12.71 Favored 'General case' 0 C--N 1.269 -2.914 0 N-CA-C 100.736 -3.802 . . . . 0.0 100.736 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . . . . . . . . . 40.6 m -98.94 95.81 7.41 Favored 'General case' 0 N--CA 1.412 -2.327 0 C-N-CA 113.871 -3.132 . . . . 0.0 109.683 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.656 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 17.1 m-20 -134.44 97.7 3.89 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 112.293 -2.231 . . . . 0.0 105.156 171.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.98 -47.33 71.5 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 118.626 0.648 . . . . 0.0 110.464 -176.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.43 -50.21 72.42 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.28 0.562 . . . . 0.0 112.082 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.656 ' HB2' ' CB ' ' X' ' 27' ' ' ASP 0.331 0.5 OUTLIER -60.86 -39.29 88.59 Favored 'General case' 0 C--O 1.185 -2.303 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.988 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 95.1 m -55.03 -41.02 70.83 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.083 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.64 ' HE2' ' CH2' ' X' ' 7' ' ' TRP . 0.7 OUTLIER -63.77 -45.01 91.69 Favored 'General case' 0 CA--C 1.467 -2.233 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 3.8 pttp -61.07 -47.41 86.46 Favored 'General case' 0 N--CA 1.41 -2.461 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.403 -177.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -61.49 -42.66 99.13 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' X' ' 55' ' ' TYR 0.498 88.6 m -60.9 -41.16 95.54 Favored 'General case' 0 N--CA 1.413 -2.301 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.533 ' CD2' ' HA ' ' X' ' 33' ' ' LYS . 13.8 m-85 -64.7 -36.73 85.22 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 107.127 -1.435 . . . . 0.0 107.127 175.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.414 ' HA ' ' HE3' ' X' ' 37' ' ' LYS . 0.0 OUTLIER -55.03 -51.31 66.68 Favored 'General case' 0 N--CA 1.42 -1.964 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -174.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . 0.437 HG22 ' H ' ' X' ' 39' ' ' GLU . 1.8 m -73.41 -149.53 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.824 0 C-N-CA 111.876 -3.93 . . . . 0.0 111.305 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . 0.437 ' H ' HG22 ' X' ' 38' ' ' THR . 2.1 mp0 -81.42 -54.85 5.11 Favored 'General case' 0 CA--C 1.467 -2.212 0 CA-C-O 125.973 2.797 . . . . 0.0 111.729 150.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' X' ' 58' ' ' VAL . 67.4 m-85 -64.3 -31.07 72.13 Favored 'General case' 0 CA--C 1.456 -2.671 1 CA-C-N 106.434 -4.894 . . . . 0.0 115.99 -160.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.675 ' HB3' ' HA ' ' X' ' 35' ' ' CYS 0.335 9.9 t -73.28 89.78 1.59 Allowed 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 115.083 -2.647 . . . . 0.0 115.226 -168.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' X' ' 79' ' ' LEU . 0.3 OUTLIER -128.45 10.16 6.16 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 113.635 -1.62 . . . . 0.0 110.475 173.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.609 ' HB ' ' HB3' ' X' ' 56' ' ' ASN . 29.5 mm -126.85 134.85 65.29 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 173.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . . . . . . . . . 22.9 t -135.7 146.59 29.46 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.851 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -128.29 131.06 48.71 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' X' ' 74' ' ' PHE . 41.2 mt-10 -122.87 140.49 52.9 Favored 'General case' 0 C--N 1.285 -2.225 0 C-N-CA 118.476 -1.29 . . . . 0.0 110.096 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -90.85 119.68 31.26 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 7.2 m -77.3 -23.94 50.99 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.235 0.54 . . . . 0.0 111.315 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 60.2 t -80.28 -45.13 22.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.492 1.139 . . . . 0.0 109.51 -174.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.9 -16.07 22.02 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.712 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.72 39.13 11.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.655 0.741 . . . . 0.0 109.904 -177.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -97.59 162.71 13.16 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.485 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . . . . . . . . . 51.4 t -127.02 120.18 28.4 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.955 -173.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.584 ' CE1' ' HD3' ' X' ' 24' ' ' LYS . 36.5 m-85 -120.84 127.18 51.67 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.704 ' HB2' ' SG ' ' X' ' 35' ' ' CYS . 14.5 p90 -117.24 129.45 55.93 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.063 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB ' ' X' ' 43' ' ' ILE . 13.8 t30 -73.84 118.69 17.1 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.181 -178.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . . . . . . . . . 34.5 m -105.17 -0.23 10.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.99 0 O-C-N 125.3 1.625 . . . . 0.0 112.429 -172.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.74 HG12 ' H ' ' X' ' 59' ' ' ASP . 8.8 t -117.61 -174.27 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 179.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.74 ' H ' HG12 ' X' ' 58' ' ' VAL . 10.9 t70 -67.44 108.65 2.89 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-O 122.044 0.926 . . . . 0.0 109.686 -176.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . 0.455 ' H ' ' HE1' ' X' ' 42' ' ' TYR . . . -105.09 8.56 45.5 Favored Glycine 0 N--CA 1.404 -3.477 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.681 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.91 -30.62 68.09 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 105.526 -2.027 . . . . 0.0 105.526 170.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -63.96 -17.41 63.25 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.313 172.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . 0.484 HD21 ' HG3' ' X' ' 20' ' ' LYS . 94.2 mt -83.48 103.79 13.11 Favored 'General case' 0 N--CA 1.421 -1.919 0 N-CA-C 106.784 -1.562 . . . . 0.0 106.784 174.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . 0.523 ' CG ' ' HD3' ' X' ' 67' ' ' LYS . 26.8 t0 -92.11 111.44 23.0 Favored 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.109 -174.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -51.73 -42.98 62.69 Favored 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 127.24 2.216 . . . . 0.0 114.36 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -78.3 -19.51 53.41 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.138 -175.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 8.5 mptt -97.73 13.87 28.87 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.079 0.942 . . . . 0.0 110.793 -174.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.625 ' CD2' ' HA ' ' X' ' 14' ' ' LYS . 2.5 m-30 -79.33 149.13 31.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.15 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.28 160.86 15.43 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.212 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 -174.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' X' ' 13' ' ' ARG . 7.4 p -81.48 114.32 22.24 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.625 0 N-CA-C 116.925 2.195 . . . . 0.0 116.925 -170.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.526 ' HB3' ' CB ' ' X' ' 14' ' ' LYS . 2.5 t70 -110.0 110.09 20.89 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 163.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -81.47 -28.81 33.95 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 123.847 0.717 . . . . 0.0 112.897 -170.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . 0.443 ' ND2' ' HD1' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -70.47 -16.43 62.91 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -176.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.554 ' HB2' ' NZ ' ' X' ' 14' ' ' LYS . 51.7 m-85 -120.76 167.68 12.23 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.098 0.475 . . . . 0.0 110.643 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.466 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 45.8 p -118.01 138.66 52.04 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 125.411 1.484 . . . . 0.0 107.208 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.576 ' OE2' ' HB3' ' X' ' 10' ' ' TYR . 0.0 OUTLIER -110.96 124.03 51.32 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.318 -178.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.16 139.58 44.71 Favored 'General case' 0 C--N 1.285 -2.232 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.998 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . 0.496 ' CE2' ' HB ' ' X' ' 80' ' ' THR . 10.7 t80 -136.9 140.7 42.5 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.858 0.463 . . . . 0.0 110.891 -176.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . 0.477 ' HB3' ' HB2' ' X' ' 42' ' ' TYR . 15.5 tp -79.6 109.11 13.67 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.284 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . 0.496 ' HB ' ' CE2' ' X' ' 78' ' ' TYR . 14.4 t -127.71 121.73 31.09 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.367 172.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 37.0 t70 52.58 73.28 0.35 Allowed 'General case' 0 C--O 1.244 0.803 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 10.8 t -165.67 35.08 0.05 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -72.62 136.26 45.68 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.332 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 126.04 -33.61 3.47 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 110.263 -1.135 . . . . 0.0 110.263 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.433 ' O ' ' HD3' ' X' ' 3' ' ' ARG . 40.4 mmtt 63.68 34.98 11.79 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.772 1.629 . . . . 0.0 110.288 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.38 0.97 43.85 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.002 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . -100.14 141.08 33.45 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.79 56.44 4.86 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.874 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . 0.479 ' ND2' ' HA ' ' X' ' 6' ' ' CYS . 7.0 t30 -81.08 108.09 14.45 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.33 -46.04 21.08 Favored 'General case' 0 C--N 1.293 -1.884 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.868 -176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.51 -84.5 0.66 Allowed 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.564 -178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.42 32.14 48.44 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . 0.452 ' HA ' ' CD1' ' X' ' 9' ' ' PHE . 3.9 t -150.12 145.87 26.58 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 114.955 -0.623 . . . . 0.0 109.653 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.402 ' HA2' HG21 ' X' ' 75' ' ' THR . . . 69.59 -92.3 0.34 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.102 -177.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 36.5 t70 56.07 -96.33 0.06 Allowed 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.98 1.312 . . . . 0.0 112.692 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 53.49 -95.25 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.171 0.988 . . . . 0.0 111.912 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 49.7 m -170.13 173.88 5.68 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 103.833 -2.655 . . . . 0.0 103.833 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -81.78 81.8 7.68 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 175.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.9 106.63 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 m -122.75 106.82 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.33 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 75.62 -43.33 0.49 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.494 1.518 . . . . 0.0 112.632 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -136.55 -45.77 0.61 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' X' X ' 1' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 CA--C 1.499 -1.017 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' X' X ' 2' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -137.27 99.62 4.03 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 3' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -166.0 176.56 7.67 Favored 'General case' 0 CA--C 1.487 -1.48 0 C-N-CA 126.287 1.835 . . . . 0.0 106.1 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 4' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' X' ' 32' ' ' LYS . 0.5 OUTLIER -121.32 128.78 52.65 Favored 'General case' 0 CA--C 1.472 -2.034 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 166.345 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 5' ' ' ASP . . . . . 0.532 ' HA ' ' CB ' ' X' ' 85' ' ' LYS . 4.0 t70 -86.89 178.57 6.93 Favored 'General case' 0 C--N 1.278 -2.527 0 C-N-CA 118.842 -1.143 . . . . 0.0 108.6 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -96.12 110.68 22.9 Favored 'General case' 0 CA--C 1.466 -2.288 0 CA-C-O 122.228 1.014 . . . . 0.0 113.032 -176.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 7' ' ' TRP . . . . . 0.41 ' CZ3' HG21 ' X' ' 44' ' ' VAL . 4.2 m0 -100.17 150.8 22.14 Favored 'General case' 0 N--CA 1.396 -3.163 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 8' ' ' THR . . . . . . . . . . . . . 24.7 m -100.68 130.32 46.71 Favored 'General case' 0 C--N 1.261 -3.242 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 9' ' ' PHE . . . . . 0.72 ' CE1' ' HA3' ' X' ' 94' ' ' GLY . 16.1 t80 -93.0 131.64 37.81 Favored 'General case' 0 N--CA 1.419 -2.007 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.135 -177.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 10' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -109.03 -56.05 2.33 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.083 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 11' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' X' ' 76' ' ' GLU . . . -169.07 167.32 10.63 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -170.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 12' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' X' ' 72' ' ' GLU . 20.4 m120 -80.58 122.18 26.74 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 103.389 -2.819 . . . . 0.0 103.389 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 13' ' ' ARG . . . . . 0.66 ' O ' ' HD2' ' X' ' 14' ' ' LYS . 55.3 mmt-85 -150.93 147.74 27.56 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 -168.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 14' ' ' LYS . . . . . 0.66 ' HD2' ' O ' ' X' ' 13' ' ' ARG . 7.2 mptt -157.35 143.83 18.01 Favored 'General case' 0 N--CA 1.523 3.221 0 C-N-CA 127.932 2.493 . . . . 0.0 111.647 163.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 15' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -94.1 50.98 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . 0.271 47.4 p 64.91 -48.25 0.34 Allowed 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 117.636 2.458 . . . . 0.0 117.636 175.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 17' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -114.3 141.06 48.07 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-O 121.88 0.847 . . . . 0.0 112.964 -170.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -93.13 24.71 3.63 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.157 -1.383 . . . . 0.0 114.556 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 19' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -55.68 -26.08 43.08 Favored 'General case' 0 N--CA 1.518 2.934 0 CA-C-O 122.6 1.191 . . . . 0.0 110.285 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 20' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' X' ' 20' ' ' LYS . 3.6 ptpp? -65.03 -5.23 5.87 Favored 'General case' 0 C--N 1.295 -1.79 0 C-N-CA 126.38 1.872 . . . . 0.0 113.881 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 21' ' ' SER . . . . . 0.406 ' O ' HG22 ' X' ' 57' ' ' VAL . 23.9 m 62.83 100.7 0.03 OUTLIER 'General case' 0 C--O 1.269 2.082 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 169.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.6 ' CD1' ' HA ' ' X' ' 56' ' ' ASN . 17.5 m-30 -121.05 154.18 36.42 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.084 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 23' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' X' ' 55' ' ' TYR . 8.4 mtpm? -114.83 140.51 48.88 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' X' ' 53' ' ' CYS . 4.1 tmmm? -122.38 120.16 33.18 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.921 0.867 . . . . 0.0 112.188 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 25' ' ' SER . . . . . . . . . . . . . 11.9 p -152.07 131.84 13.23 Favored 'General case' 0 C--N 1.269 -2.902 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 168.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 26' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' X' ' 52' ' ' GLU . 16.3 m -94.51 97.34 10.08 Favored 'General case' 0 N--CA 1.426 -1.671 0 C-N-CA 115.48 -2.488 . . . . 0.0 109.888 -175.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 27' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' X' ' 30' ' ' GLU . 18.0 m-20 -132.56 112.32 11.97 Favored 'General case' 0 CA--C 1.472 -2.028 0 CA-C-N 113.227 -1.806 . . . . 0.0 107.294 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 28' ' ' LEU . . . . . 0.668 ' O ' ' HD3' ' X' ' 32' ' ' LYS . 5.6 tt -68.58 -48.68 63.57 Favored 'General case' 0 C--N 1.29 -1.98 0 C-N-CA 118.552 -1.259 . . . . 0.0 108.771 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -63.9 -51.59 63.8 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 122.406 1.098 . . . . 0.0 110.103 176.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 30' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' X' ' 33' ' ' LYS 0.473 25.3 mt-10 -64.02 -40.81 97.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -173.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -58.05 -45.41 87.07 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.122 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 32' ' ' LYS . . . . . 0.668 ' HD3' ' O ' ' X' ' 28' ' ' LEU . 7.7 mptt -64.24 -44.27 92.33 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.891 -176.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 33' ' ' LYS . . . . . 0.704 ' HG2' ' O ' ' X' ' 30' ' ' GLU . 31.4 pttt -61.09 -43.5 98.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.143 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 34' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' X' ' 37' ' ' LYS . 25.4 m -62.32 -42.89 99.75 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-O 121.347 0.594 . . . . 0.0 110.064 -179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 35' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' X' ' 41' ' ' CYS 0.477 6.9 m -61.91 -42.36 99.0 Favored 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 174.689 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 36' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' X' ' 5' ' ' ASP . 17.6 m-85 -64.49 -36.31 83.78 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 37' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' X' ' 34' ' ' THR 0.34 13.8 ptmm? -61.66 -51.63 67.66 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 -177.082 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.57 -149.82 0.02 OUTLIER 'General case' 0 C--N 1.406 3.032 0 C-N-CA 112.41 -3.716 . . . . 0.0 111.968 -174.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 39' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -82.78 -56.17 3.99 Favored 'General case' 0 CA--C 1.473 -2.008 0 CA-C-O 125.384 2.516 . . . . 0.0 114.022 148.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 40' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -64.71 -31.08 72.14 Favored 'General case' 0 CA--C 1.456 -2.649 1 CA-C-N 107.24 -4.527 . . . . 0.0 114.583 -163.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 41' ' ' CYS . . . . . 0.644 ' HB3' ' HA ' ' X' ' 35' ' ' CYS . 5.0 t -75.11 83.0 2.3 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-O 122.277 1.037 . . . . 0.0 109.848 -171.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.38 -1.56 2.56 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.089 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 43' ' ' ILE . . . . . 0.561 ' O ' ' HB3' ' X' ' 56' ' ' ASN . 27.6 mm -116.18 133.67 61.95 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.415 0 N-CA-C 104.867 -2.272 . . . . 0.0 104.867 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 44' ' ' VAL . . . . . 0.41 HG21 ' CZ3' ' X' ' 7' ' ' TRP . 3.2 t -136.84 147.16 27.4 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.351 0 C-N-CA 119.248 -0.981 . . . . 0.0 108.775 -177.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 45' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -129.11 128.82 44.28 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 173.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 46' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -127.9 133.47 49.3 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.894 -176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.63 ' HB2' ' CE2' ' X' ' 74' ' ' PHE . 10.8 t70 -93.91 121.86 35.8 Favored 'General case' 0 CA--C 1.487 -1.444 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.549 -170.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 48' ' ' THR . . . . . . . . . . . . . 12.1 m -83.19 -22.93 33.06 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.873 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 49' ' ' VAL . . . . . . . . . . . . . 47.3 t -79.79 -46.39 22.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 122.234 1.016 . . . . 0.0 109.759 -175.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 50' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -91.53 -13.75 31.57 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.191 -1.368 . . . . 0.0 110.382 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 61.34 33.89 18.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.043 0.839 . . . . 0.0 110.651 -176.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 52' ' ' GLU . . . . . 0.446 ' HA ' ' OG ' ' X' ' 26' ' ' SER . 39.9 mt-10 -103.58 161.86 13.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.623 -175.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 53' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' X' ' 24' ' ' LYS . 37.4 t -127.19 120.27 28.38 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -172.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 54' ' ' TYR . . . . . 0.455 ' CE1' ' HG3' ' X' ' 24' ' ' LYS . 8.3 m-85 -121.3 126.86 50.56 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.714 -1.588 . . . . 0.0 106.714 176.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 55' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' X' ' 23' ' ' LYS . 19.8 p90 -118.51 132.38 56.22 Favored 'General case' 0 C--N 1.268 -2.958 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.134 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 56' ' ' ASN . . . . . 0.6 ' HA ' ' CD1' ' X' ' 22' ' ' PHE . 2.8 t30 -71.82 119.38 15.91 Favored 'General case' 0 CA--C 1.47 -2.11 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.028 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 57' ' ' VAL . . . . . 0.406 HG22 ' O ' ' X' ' 21' ' ' SER . 27.8 m -106.3 -5.8 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 O-C-N 124.689 1.243 . . . . 0.0 112.624 -173.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 58' ' ' VAL . . . . . 0.676 HG12 ' H ' ' X' ' 59' ' ' ASP . 3.4 t -111.1 179.95 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 59' ' ' ASP . . . . . 0.676 ' H ' HG12 ' X' ' 58' ' ' VAL . 25.9 t70 -66.19 111.88 3.66 Favored 'General case' 0 C--N 1.29 -1.99 0 C-N-CA 124.41 1.084 . . . . 0.0 108.574 -178.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 60' ' ' GLY . . . . . . . . . . . . . . . -146.5 28.42 1.64 Allowed Glycine 0 N--CA 1.401 -3.672 0 CA-C-N 114.762 -1.108 . . . . 0.0 112.985 -174.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 61' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.74 -24.17 64.42 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 172.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -72.72 -5.66 39.23 Favored 'General case' 0 N--CA 1.412 -2.364 0 CA-C-N 112.662 -2.063 . . . . 0.0 109.852 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.05 102.85 8.61 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 117.567 -1.653 . . . . 0.0 108.086 175.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 64' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -96.92 133.63 41.31 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.581 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 65' ' ' GLN . . . . . . . . . . . . . 9.3 mp0 -62.33 -32.09 72.8 Favored 'General case' 0 C--N 1.294 -1.848 0 C-N-CA 126.544 1.938 . . . . 0.0 111.326 -173.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 66' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -89.18 -18.1 27.81 Favored 'General case' 0 N--CA 1.417 -2.121 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.452 -169.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 67' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' X' ' 67' ' ' LYS . 7.1 mptt -94.75 -7.43 40.54 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 122.129 0.966 . . . . 0.0 108.539 173.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 68' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' X' ' 13' ' ' ARG . 3.1 m-85 -79.88 151.03 30.41 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 113.476 -1.693 . . . . 0.0 108.936 172.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.99 164.82 11.99 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.748 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 -175.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 70' ' ' VAL . . . . . . . . . . . . 0.309 3.4 p -80.23 116.61 24.68 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.394 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 -169.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 71' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' X' ' 12' ' ' ASN . 9.2 t70 -113.49 104.9 12.74 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 112.097 -2.319 . . . . 0.0 106.379 171.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 72' ' ' GLU . . . . . 0.469 ' H ' ' CD ' ' X' ' 72' ' ' GLU . 0.1 OUTLIER -80.12 -30.23 39.03 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -168.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 73' ' ' ASN . . . . . 0.438 HD22 ' N ' ' X' ' 74' ' ' PHE . 0.2 OUTLIER -65.97 -27.43 68.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.334 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 74' ' ' PHE . . . . . 0.63 ' CE2' ' HB2' ' X' ' 47' ' ' ASP . 92.5 m-85 -109.0 171.13 7.61 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 121.853 0.835 . . . . 0.0 110.186 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 75' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' X' ' 9' ' ' PHE . 39.3 p -118.56 134.13 55.33 Favored 'General case' 0 N--CA 1.402 -2.838 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 76' ' ' GLU . . . . . 0.479 ' HB3' ' O ' ' X' ' 11' ' ' ALA . 25.5 tt0 -96.2 118.73 33.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.155 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 77' ' ' ASN . . . . . 0.433 ' HB3' ' HD1' ' X' ' 9' ' ' PHE . 0.0 OUTLIER -144.74 124.02 13.0 Favored 'General case' 0 C--N 1.278 -2.533 0 C-N-CA 119.903 -0.719 . . . . 0.0 109.221 -175.47 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 78' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -125.7 145.04 50.35 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.939 -0.704 . . . . 0.0 110.873 -173.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 79' ' ' LEU . . . . . . . . . . . . . 57.6 tp -87.57 101.86 14.04 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.668 0.747 . . . . 0.0 111.087 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 80' ' ' THR . . . . . . . . . . . . . 9.2 t -126.83 126.57 43.57 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.128 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 p30 54.05 -20.84 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 N-CA-C 119.094 2.998 . . . . 0.0 119.094 169.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 82' ' ' CYS . . . . . . . . . . . . . 25.6 t -79.11 -2.19 39.46 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 118.659 0.663 . . . . 0.0 110.687 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 83' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -40.83 119.49 1.14 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.736 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 84' ' ' GLY . . . . . . . . . . . . . . . 123.09 38.54 0.56 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 85' ' ' LYS . . . . . 0.532 ' CB ' ' HA ' ' X' ' 5' ' ' ASP . 0.3 OUTLIER -73.72 121.85 21.44 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 86' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -157.52 173.02 17.51 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 176.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 87' ' ' ALA . . . . . . . . . . . . . . . 68.22 18.92 9.21 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.573 1.149 . . . . 0.0 110.394 -176.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 88' ' ' GLY . . . . . 0.473 ' O ' ' HE3' ' X' ' 85' ' ' LYS . . . -168.9 164.4 38.05 Favored Glycine 0 N--CA 1.413 -2.851 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 89' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -168.38 -179.01 3.78 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 117.031 0.415 . . . . 0.0 109.93 -176.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 90' ' ' ALA . . . . . . . . . . . . . . . 71.01 26.79 3.47 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 125.514 1.525 . . . . 0.0 113.162 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 91' ' ' ALA . . . . . . . . . . . . . . . -145.87 118.32 8.5 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.658 -0.817 . . . . 0.0 112.84 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.98 66.06 0.18 Allowed Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.636 177.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 93' ' ' THR . . . . . . . . . . . . . 23.3 p -160.98 173.02 15.87 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 105.062 -2.199 . . . . 0.0 105.062 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 94' ' ' GLY . . . . . 0.72 ' HA3' ' CE1' ' X' ' 9' ' ' PHE . . . -88.84 13.98 61.46 Favored Glycine 0 N--CA 1.427 -1.918 0 C-N-CA 117.549 -2.262 . . . . 0.0 112.409 173.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 95' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -104.91 -40.51 5.91 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 173.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 96' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -80.42 74.04 7.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.822 0.82 . . . . 0.0 109.327 173.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 97' ' ' SER . . . . . . . . . . . . . 16.6 m -147.64 26.17 1.04 Allowed 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 98' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.07 154.51 31.3 Favored 'General case' 0 C--O 1.253 1.251 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.357 -173.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 99' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -75.21 68.86 2.01 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 122.082 0.944 . . . . 0.0 110.752 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 100' ' ' VAL . . . . . 0.502 HG23 ' H ' ' X' ' 101' ' ' ASP . 1.6 m -130.01 -80.69 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 CA-C-N 114.205 -1.362 . . . . 0.0 110.283 176.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 101' ' ' ASP . . . . . 0.502 ' H ' HG23 ' X' ' 100' ' ' VAL . 6.6 m-20 -116.83 7.15 13.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.334 0.588 . . . . 0.0 109.807 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 102' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -103.29 -18.74 14.74 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.682 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.428 -1.55 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 177.408 . . . . . . . . 0 0 . 1 stop_ save_